12,13-diazatricyclo[BLAH.BLAH.BLAH.BLAH]trideca-1(3),2(7),8-trien-11-one O=C1Nc2cccc3c2C1CCNC3 3 11 2 1 0 12_13-diazatricyclo-blah.blah.blah.blah-trideca-1-3-_2-7-_8-trien-11-one 3a,4,5,8,9,9a-hexahydrocycloocta[d]isoxazole C1=CCCC2ON=CC2CC1 2 9 1 1 0 3a_4_5_8_9_9a-hexahydrocycloocta-d-isoxazole isochroman-1-one O=C1OCCc2ccccc21 2 9 0 2 0 isochroman-1-one 2,6-dihydrotriazolo[4,5-f]quinolin-7-one O=c1ccc2c(ccc3n[nH]nc32)[nH]1 3 9 4 1 0 2_6-dihydrotriazolo-4_5-f-quinolin-7-one 8,8-dioxo-3-oxa-8$l^{6}-thia-1-azaspiro[4.5]decan-2-one O=C1NC2(CCS(=O)(=O)CC2)CO1 2 7 1 4 1 8_8-dioxo-3-oxa-8$l^{6}-thia-1-azaspiro-4.5-decan-2-one piperazine-2,5-dione O=C1CNC(=O)CN1 1 4 2 2 0 piperazine-2_5-dione 2-azaspiro[3.3]heptane C1CC2(C1)CNC2 2 6 1 0 0 2-azaspiro-3.3-heptane 6,7-dihydrofuro[BLAH]pyrazolo[BLAH]pyrimidine c1cc2nc3c(cn2n1)CCO3 3 8 3 1 0 6_7-dihydrofuro-blah-pyrazolo-blah-pyrimidine 7H-pyrrolo[2,3-d]pyrimidine c1ncc2cc[nH]c2n1 2 6 3 0 0 7h-pyrrolo-2_3-d-pyrimidine spiro[2,3,3a,6a-tetrahydrofuro[3,2-b]furan-6,5'-tetrahydrofuran]-2',5-dione O=C1CCC2(O1)C(=O)OC1CCOC12 3 9 0 5 0 spiro-2_3_3a_6a-tetrahydrofuro-3_2-b-furan-6_5--tetrahydrofuran--2-_5-dione LKRNZLYYWVHIFZ-UHFFFAOYSA-O C1=NN=C2CNC=c3ccccc3=[N+]12 3 10 4 0 0 LKRNZLYYWVHIFZ-UHFFFAOYSA-O VRLHMBJPLVZPJO-UHFFFAOYSA-N O=c1[nH]c2ccccc2c2c1CC=CN2 3 12 2 1 0 VRLHMBJPLVZPJO-UHFFFAOYSA-N 2,5,6,11b-tetrahydro-1H-pyrrolo[1,2-d][1,4]benzothiazepin-3-one O=C1CCC2c3ccccc3SCCN12 3 12 1 1 1 2_5_6_11b-tetrahydro-1h-pyrrolo-1_2-d--1_4-benzothiazepin-3-one 13,14-dioxatetracyclo[BLAH.BLAH.BLAH.BLAH.BLAH]tetradec-7(11)-ene C1=C2CC3CCCC4OC34CC2OC1 4 12 0 2 0 13_14-dioxatetracyclo-blah.blah.blah.blah.blah-tetradec-7-11--ene furo[2,3-g]quinoline c1cnc2cc3ccoc3cc2c1 3 11 1 1 0 furo-2_3-g-quinoline 1,2,3,3a,4,5,6,6a-octahydropyrrolo[2,3-b]pyrrole C1CC2CCNC2N1 2 6 2 0 0 1_2_3_3a_4_5_6_6a-octahydropyrrolo-2_3-b-pyrrole 7,10-dihydropyrido[1,2]pyrimido[4,5-b][1,2,4]triazin-5-one O=c1nc2n(c3ncccc13)CC=NN2 3 9 5 1 0 7_10-dihydropyrido-1_2-pyrimido-4_5-b--1_2_4-triazin-5-one 14,15-dioxatetracyclo[BLAH.BLAH.BLAH.BLAH.BLAH]tetradeca-1,6-dien-12-one O=C1c2occc2CC2CC3OC3CC12 4 12 0 3 0 14_15-dioxatetracyclo-blah.blah.blah.blah.blah-tetradeca-1_6-dien-12-one 2-oxo-2$l^{6}-thia-3,5,7,9-tetrazabicyclo[4.3.0]nona-1,5,7-trien-4-one O=C1N=c2nc[nH]c2=[SH](=O)N1 2 4 4 2 1 2-oxo-2$l^{6}-thia-3_5_7_9-tetrazabicyclo-4.3.0-nona-1_5_7-trien-4-one spiro[4H-oxazole-5,4'-chromane] C1=NCC2(CCOc3ccccc32)O1 3 11 1 2 0 spiro-4h-oxazole-5_4--chromane- cyclopenta[b]indole C1=CC2=Nc3ccccc3C2=C1 3 11 1 0 0 cyclopenta-b-indole 1,4a,5,6,7,8,8a,9-octahydropyrrolo[2,3-g]isoquinolin-4-one O=C1c2cc[nH]c2CC2CCNCC12 3 11 2 1 0 1_4a_5_6_7_8_8a_9-octahydropyrrolo-2_3-g-isoquinolin-4-one 7,8,9-trioxatricyclo[BLAH.BLAH.BLAH.BLAH]non-1-ene C1=CC2OC2OC2OC12 3 6 0 3 0 7_8_9-trioxatricyclo-blah.blah.blah.blah-non-1-ene 2,3,4,4a,5,6,7,8a-octahydro-[1,4]oxazino[2,3-b][1,4]oxazine C1COC2OCCNC2N1 2 6 2 2 0 2_3_4_4a_5_6_7_8a-octahydro--1_4-oxazino-2_3-b--1_4-oxazine 2-thioxo-3a,7a-dihydro-3H-thieno[1,2]cyclopenta[3,5-b]oxazol-7-one O=C1c2cscc2C2NC(=S)OC12 3 8 1 2 2 2-thioxo-3a_7a-dihydro-3h-thieno-1_2-cyclopenta-3_5-b-oxazol-7-one 8,10-diazabicyclo[4.2.2]dec-3-ene-7,9-dione O=C1NC2CC=CCC1NC2=O 3 8 2 2 0 8_10-diazabicyclo-4.2.2-dec-3-ene-7_9-dione 5,7-dihydrofuro[BLAH]pyrazolo[BLAH]pyrimidine c1cc2nc3c(cn2n1)COC3 3 8 3 1 0 5_7-dihydrofuro-blah-pyrazolo-blah-pyrimidine 1,7-dihydro-1,8-naphthyridine C1=CNC2=NCC=CC2=C1 2 8 2 0 0 1_7-dihydro-1_8-naphthyridine 2-thioxo-3a,7a-dihydro-1H-thieno[1,2]cyclopenta[3,5-b]oxazol-7-one O=C1c2cscc2C2OC(=S)NC12 3 8 1 2 2 2-thioxo-3a_7a-dihydro-1h-thieno-1_2-cyclopenta-3_5-b-oxazol-7-one bicyclo[4.2.0]octa-1,5-diene-3,4-dione O=C1C=C2CCC2=CC1=O 2 8 0 2 0 bicyclo-4.2.0-octa-1_5-diene-3_4-dione spiro[4H-oxazole-5,2'-indane] C1=NCC2(Cc3ccccc3C2)O1 3 11 1 1 0 spiro-4h-oxazole-5_2--indane- 8,10-diazabicyclo[4.2.2]decane-7,9-dione O=C1NC2CCCCC1NC2=O 3 8 2 2 0 8_10-diazabicyclo-4.2.2-decane-7_9-dione 4,4a,5,6-tetrahydro-1aH-oxireno[2,3-d]isochromen-2-one O=C1OCC2CCC=CC23OC13 3 9 0 3 0 4_4a_5_6-tetrahydro-1ah-oxireno-2_3-d-isochromen-2-one 7-thioxo-6H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one O=c1cnnc2sc(=S)[nH]n12 2 4 4 1 2 7-thioxo-6h--1_3_4-thiadiazolo-2_3-c--1_2_4-triazin-4-one 14,15-dioxatricyclo[BLAH.BLAH.BLAH.BLAH]tetradeca-5,7(11)-dien-12-one O=C1C=C2CCC3CCC(C=CC2O1)O3 3 12 0 3 0 14_15-dioxatricyclo-blah.blah.blah.blah-tetradeca-5_7-11--dien-12-one 1,3-oxathiolane 3-oxide O=S1CCOC1 1 3 0 2 1 1_3-oxathiolane-3-oxide 1,8-dioxa-3-azaspiro[4.5]dec-2-ene C1=NCC2(CCOCC2)O1 2 7 1 2 0 1_8-dioxa-3-azaspiro-4.5-dec-2-ene 10-methylene-4,5-dihydrobenzo[1,2]cyclohepta[2,4-b]thiophene C=C1c2ccccc2CCc2sccc21 3 14 0 0 1 10-methylene-4_5-dihydrobenzo-1_2-cyclohepta-2_4-b-thiophene 3,3a,4,5,5a,6,9,10,10a,10b-decahydrocyclohepta[e]indene C1=CCC2CCC3CC=CC3C2CC1 3 14 0 0 0 3_3a_4_5_5a_6_9_10_10a_10b-decahydrocyclohepta-e-indene 14,15-dioxatricyclo[BLAH.BLAH.BLAH.BLAH]tetradeca-5(9),6(11),7(10)-trien-12-one O=C1C=C2CCCC3=CCC(C=C2O1)O3 3 12 0 3 0 14_15-dioxatricyclo-blah.blah.blah.blah-tetradeca-5-9-_6-11-_7-10--trien-12-one imidazo[4,5-h]quinazolin-6-one O=C1N=CN=c2c1ccc1c2=NC=N1 3 9 4 1 0 imidazo-4_5-h-quinazolin-6-one 6,7-dihydro-1H-pyrrolo[2,3-b]pyridine C1=Cc2cc[nH]c2NC1 2 7 2 0 0 6_7-dihydro-1h-pyrrolo-2_3-b-pyridine 1-oxa-3,9-diazaspiro[4.6]undec-2-ene C1=NCC2(CCCNCC2)O1 2 8 2 1 0 1-oxa-3_9-diazaspiro-4.6-undec-2-ene 4,5,5a,6,9,10,10a,10b-octahydro-3aH-cyclohepta[e]inden-3-one O=C1C=CC2C1CCC1CC=CCCC12 3 14 0 1 0 4_5_5a_6_9_10_10a_10b-octahydro-3ah-cyclohepta-e-inden-3-one 14,15-dioxatricyclo[BLAH.BLAH.BLAH.BLAH]tetradec-7(11)-en-12-one O=C1C=C2CCCCCCC3OC3C2O1 3 12 0 3 0 14_15-dioxatricyclo-blah.blah.blah.blah-tetradec-7-11--en-12-one 1,7-dioxa-3-azaspiro[4.4]non-2-ene C1=NCC2(CCOC2)O1 2 6 1 2 0 1_7-dioxa-3-azaspiro-4.4-non-2-ene CKRLXIDKVSHTLB-UHFFFAOYSA-N c1ccc2c(c1)ccc1ccc3c(c12)O3 4 14 0 1 0 CKRLXIDKVSHTLB-UHFFFAOYSA-N 14-oxatetracyclo[BLAH.BLAH.BLAH.BLAH.BLAH]dodecane-10,11-dione O=C1CCC(=O)C2C3CC(C4OC34)C12 4 11 0 3 0 14-oxatetracyclo-blah.blah.blah.blah.blah-dodecane-10_11-dione 9-methylene-10,11,12-triazatricyclo[BLAH.BLAH.BLAH.BLAH]undec-3-ene-5,6-dione C=C1CC2C=CC1n1c(=O)[nH]c(=O)n12 4 9 3 2 0 9-methylene-10_11_12-triazatricyclo-blah.blah.blah.blah-undec-3-ene-5_6-dione 1H-pyrazolo[BLAH]pyrimido[BLAH][1,2,4]triazine-2-thione S=c1ncc2nnc3ccnn3c2[nH]1 3 7 6 0 1 1h-pyrazolo-blah-pyrimido-blah--1_2_4-triazine-2-thione 7-azaspiro[3.5]nonane-1,3-dione O=C1CC(=O)C12CCNCC2 2 8 1 2 0 7-azaspiro-3.5-nonane-1_3-dione 12,13-diazatricyclo[BLAH.BLAH.BLAH.BLAH]dodeca-1(3),2(6),4(8),7(9)-tetraen-10-imine N=C1NCc2c[nH]c3cccc1c23 3 10 3 0 0 12_13-diazatricyclo-blah.blah.blah.blah-dodeca-1-3-_2-6-_4-8-_7-9--tetraen-10-imine 1-oxa-3,7-diazaspiro[4.4]non-2-ene C1=NCC2(CCNC2)O1 2 6 2 1 0 1-oxa-3_7-diazaspiro-4.4-non-2-ene 1,2,3,4,4a,5,8,8a-octahydronaphthalene C1=CCC2CCCCC2C1 2 10 0 0 0 1_2_3_4_4a_5_8_8a-octahydronaphthalene 6-methylene-11-oxabicyclo[8.1.0]undecan-7-one C=C1CCCCC2OC2CCC1=O 2 11 0 2 0 6-methylene-11-oxabicyclo-8.1.0-undecan-7-one FPUBPIJWWUKQJY-UHFFFAOYSA-N O=C1NC2(Nc3c1sc1ncccc31)C(=O)Nc1ccccc12 5 16 4 2 1 FPUBPIJWWUKQJY-UHFFFAOYSA-N spiro[1H-pyrazole-4,6'-3-azabicyclo[3.1.0]hex-3-ene]-5-one O=C1NN=CC12C1C=NCC12 3 7 3 1 0 spiro-1h-pyrazole-4_6--3-azabicyclo-3.1.0-hex-3-ene--5-one 6H-pyrazolo[4,3-d]isothiazole c1n[nH]c2sncc12 2 4 3 0 1 6h-pyrazolo-4_3-d-isothiazole 14,15-dioxatetracyclo[BLAH.BLAH.BLAH.BLAH.BLAH]tetradec-6(10)-en-11-one O=C1C=C2CC3CCCC34OC4CC2O1 4 12 0 3 0 14_15-dioxatetracyclo-blah.blah.blah.blah.blah-tetradec-6-10--en-11-one UOORPSZORRGXMY-UHFFFAOYSA-N O=C1NC2(CCNCC2)Nc2c1sc1ncccc21 4 13 4 1 1 UOORPSZORRGXMY-UHFFFAOYSA-N 1,9-dioxa-3-azaspiro[4.6]undec-2-ene C1=NCC2(CCCOCC2)O1 2 8 1 2 0 1_9-dioxa-3-azaspiro-4.6-undec-2-ene 6,11-dihydro-5H-benzo[c][1]benzazepine c1ccc2c(c1)CNc1ccccc1C2 3 14 1 0 0 6_11-dihydro-5h-benzo-c--1-benzazepine LOTZGUJAOFTSDT-UHFFFAOYSA-N C1=C=CSC=1 1 4 0 0 1 LOTZGUJAOFTSDT-UHFFFAOYSA-N 5,6-dihydro-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one O=C1CCN2N=CSC2=N1 2 5 3 1 1 5_6-dihydro--1_3_4-thiadiazolo-3_2-a-pyrimidin-7-one 4,9,12-trioxa-2-azadispiro[4.2.4^{8}.2^{5}]tetradec-2-ene C1=NCC2(CCC3(CC2)OCCO3)O1 3 10 1 3 0 4_9_12-trioxa-2-azadispiro-4.2.4^{8}.2^{5}-tetradec-2-ene 2,3-dihydro-1H-[1,2,4]triazolo[1,5-a]pyrimidin-8-ium c1cnc2[n+](c1)NCN2 2 5 4 0 0 2_3-dihydro-1h--1_2_4-triazolo-1_5-a-pyrimidin-8-ium UMRVQEHPQLVJEO-UHFFFAOYSA-N N=c1ccc2c([nH]1)CC(=O)NC2 2 8 3 1 0 UMRVQEHPQLVJEO-UHFFFAOYSA-N 14,15-dioxatetracyclo[BLAH.BLAH.BLAH.BLAH.BLAH]tetradec-6(10)-en-11-one O=C1C=C2CCCC3CCC4OC34C2O1 4 12 0 3 0 14_15-dioxatetracyclo-blah.blah.blah.blah.blah-tetradec-6-10--en-11-one XLXOCTCDGBCQNN-UHFFFAOYSA-N C1=Nc2c3cccnc3nn2CN1 3 8 5 0 0 XLXOCTCDGBCQNN-UHFFFAOYSA-N pyrido[4,3-f]quinoxaline c1cc2c(ccc3nccnc32)cn1 3 11 3 0 0 pyrido-4_3-f-quinoxaline NSPSQYUYBXIXSG-UHFFFAOYSA-N C1CCCOCCCCNCC1 1 10 1 1 0 NSPSQYUYBXIXSG-UHFFFAOYSA-N 7,9-dihydro-[1,2,4]triazolo[4,3-b][1,2,4]triazepin-8-one O=C1CC=Nn2cnnc2N1 2 5 5 1 0 7_9-dihydro--1_2_4-triazolo-4_3-b--1_2_4-triazepin-8-one 3,7-dihydro-1H-pyrrolo[3,4-e][1,4]diazepin-2-one O=C1CN=Cc2c[nH]cc2N1 2 7 3 1 0 3_7-dihydro-1h-pyrrolo-3_4-e--1_4-diazepin-2-one 2,5-dimethylene-3,3a,6,6a-tetrahydropentalene-1,4-dione C=C1CC2C(=O)C(=C)CC2C1=O 2 10 0 2 0 2_5-dimethylene-3_3a_6_6a-tetrahydropentalene-1_4-dione 2,6,7,8-tetrahydro-1H-pyrrolizine-3,5-dione O=C1CCC2CCC(=O)N12 2 7 1 2 0 2_6_7_8-tetrahydro-1h-pyrrolizine-3_5-dione 8,8-dioxo-1-oxa-8$l^{6}-thia-3-azaspiro[4.5]decan-2-one O=C1NCC2(CCS(=O)(=O)CC2)O1 2 7 1 4 1 8_8-dioxo-1-oxa-8$l^{6}-thia-3-azaspiro-4.5-decan-2-one JKGIKKPCPZOWIZ-UHFFFAOYSA-N O=C1CC2(CCCC2)NC(=S)N1 2 8 2 1 1 JKGIKKPCPZOWIZ-UHFFFAOYSA-N spiro[3,4-dihydro-1,3-benzoxazine-2,1'-cyclohexane] c1ccc2c(c1)CNC1(CCCCC1)O2 3 13 1 1 0 spiro-3_4-dihydro-1_3-benzoxazine-2_1--cyclohexane- SUFIKLJXQAMOQC-UHFFFAOYSA-N C1#CCNCCCNC1 1 7 2 0 0 SUFIKLJXQAMOQC-UHFFFAOYSA-N 3,4-dihydrobenzo[g]isochromen-9-one O=C1C=CC=c2cc3c(cc21)=COCC3 3 13 0 2 0 3_4-dihydrobenzo-g-isochromen-9-one 4,5,6,8-tetrahydropyrazolo[1,2]cyclohepta[3,4-c]thiazole c1nc2c(s1)CCCc1n[nH]cc1-2 3 9 3 0 1 4_5_6_8-tetrahydropyrazolo-1_2-cyclohepta-3_4-c-thiazole PVQFFMPYOXBGMM-UHFFFAOYSA-N O=C1OCc2c1ccc1c2CCOC1 3 11 0 3 0 PVQFFMPYOXBGMM-UHFFFAOYSA-N 5,6,6a,7,8,9,10,10a-octahydropyrimido[4,5-c][2,6]naphthyridine c1ncc2c(n1)NCC1CCNCC21 3 10 4 0 0 5_6_6a_7_8_9_10_10a-octahydropyrimido-4_5-c--2_6-naphthyridine 8-methylene-1,3,4,5-tetrahydropyrano[4,3-d]pyrimidine-2-thione C=C1COCC2=C1NC(=S)NC2 2 8 2 1 1 8-methylene-1_3_4_5-tetrahydropyrano-4_3-d-pyrimidine-2-thione furo[3,4-d]isoxazole c1noc2cocc12 2 5 1 2 0 furo-3_4-d-isoxazole hexahydropyrimidine-4,6-dione O=C1CC(=O)NCN1 1 4 2 2 0 hexahydropyrimidine-4_6-dione thieno[2,3-h]chromen-2-one O=c1ccc2ccc3sccc3c2o1 3 11 0 2 1 thieno-2_3-h-chromen-2-one WJFJECOBQUNYRJ-UHFFFAOYSA-N O=S1(=O)CCS(=O)(=O)OCO1 1 3 0 6 2 WJFJECOBQUNYRJ-UHFFFAOYSA-N 12-oxatricyclo[BLAH.BLAH.BLAH.BLAH]dodec-7-ene C1=CC2CC3(C1)CCCC3CO2 3 11 0 1 0 12-oxatricyclo-blah.blah.blah.blah-dodec-7-ene 1,4,5,6-tetrahydro-1,4-benzodiazocine-2,3-dione O=C1NCCc2ccccc2NC1=O 2 10 2 2 0 1_4_5_6-tetrahydro-1_4-benzodiazocine-2_3-dione FRZJJVVOSBWABR-UHFFFAOYSA-N O=C1NC2(Nc3ccccc31)C(=O)NC1C=CC=CC12 4 15 3 2 0 FRZJJVVOSBWABR-UHFFFAOYSA-N spiro[8-azabicyclo[3.2.1]octane-3,5'-oxazolidine]-2'-one O=C1NCC2(CC3CCC(C2)N3)O1 3 9 2 2 0 spiro-8-azabicyclo-3.2.1-octane-3_5--oxazolidine--2--one 6,7-dihydrocyclopenta[e][1,3]benzodioxol-8-one O=C1CCc2ccc3c(c21)OCO3 3 10 0 3 0 6_7-dihydrocyclopenta-e--1_3-benzodioxol-8-one 3-methylene-1H-1,4-benzodiazepine-2,5-dione C=C1NC(=O)c2ccccc2NC1=O 2 10 2 2 0 3-methylene-1h-1_4-benzodiazepine-2_5-dione 1,2,4a,5,6,7,8,8a-octahydrothiazolo[3,2-a]benzimidazole C1CCC2C(C1)N=C1SCCN12 3 9 2 0 1 1_2_4a_5_6_7_8_8a-octahydrothiazolo-3_2-a-benzimidazole ZBGMORRQGYFOOR-UHFFFAOYSA-N O=C1NC2(CCNCC2)N2CCc3ccccc3C12 4 15 3 1 0 ZBGMORRQGYFOOR-UHFFFAOYSA-N 6,7,8,9-tetrahydrobenzo[g]chromen-4-one O=c1ccoc2cc3c(cc12)CCCC3 3 13 0 2 0 6_7_8_9-tetrahydrobenzo-g-chromen-4-one 5,7,8,9-tetrahydrothiazolo[2,3-b]quinazoline-3,6-dione O=C1CCCC2=C1CN1C(=O)CSC1=N2 3 10 2 2 1 5_7_8_9-tetrahydrothiazolo-2_3-b-quinazoline-3_6-dione 1,7-dioxa-3-azaspiro[4.4]nonan-2-one O=C1NCC2(CCOC2)O1 2 6 1 3 0 1_7-dioxa-3-azaspiro-4.4-nonan-2-one 8-azatricyclo[BLAH.BLAH.BLAH.BLAH]octan-7-one O=C1NC2CC3C(C2)C13 4 7 1 1 0 8-azatricyclo-blah.blah.blah.blah-octan-7-one