CAS RN: 6684-61-3
CAS Name: [(E)-(4-methyl-8-spiro[2.5]octanylidene)amino]urea
OPENEYE Name: [(E)-(4-methylspiro[2.5]octan-8-ylidene)amino]urea
IUPAC Name: [(E)-(4-methylspiro[2.5]octan-8-ylidene)amino]urea
SYSTEMATIC NAME: 1-[(E)-(4-methylspiro[2.5]octan-8-ylidene)amino]urea
MOLECULAR FORMULA: C10H17N3O
MOLECULAR WEIGHT: 195.26148
SMILES: CC1CCC/C(=N\NC(=O)N)/C12CC2
Structure:
CAS RN: 65624-40-0
CAS Name: 4-[[4-[bis(2-chloroethyl)sulfamoyl]phenyl]hydrazinylidene]-3-oxo-2-naphthalenecarboxylic acid
OPENEYE Name: 4-[[4-[bis(2-chloroethyl)sulfamoyl]phenyl]hydrazono]-3-oxo-naphthalene-2-carboxylic acid
IUPAC Name: 4-[[4-[bis(2-chloroethyl)sulfamoyl]phenyl]hydrazinylidene]-3-oxonaphthalene-2-carboxylic acid
SYSTEMATIC NAME: 4-[[4-[bis(2-chloroethyl)sulfamoyl]phenyl]hydrazinylidene]-3-oxidanylidene-naphthalene-2-carboxylic acid
MOLECULAR FORMULA: C21H19Cl2N3O5S
MOLECULAR WEIGHT: 496.36366
SMILES: C1=CC=C2C(=C1)C=C(C(=O)C2=NNC3=CC=C(C=C3)S(=O)(=O)N(CCCl)CCCl)C(=O)O
Structure:
CAS RN: 65624-34-2
CAS Name: 3-[[4-[bis(2-chloroethyl)sulfamoyl]phenyl]hydrazinylidene]-6-oxo-1-cyclohexa-1,4-dienecarboxylic acid
OPENEYE Name: 3-[[4-[bis(2-chloroethyl)sulfamoyl]phenyl]hydrazono]-6-oxo-cyclohexa-1,4-diene-1-carboxylic acid
IUPAC Name: 3-[[4-[bis(2-chloroethyl)sulfamoyl]phenyl]hydrazinylidene]-6-oxocyclohexa-1,4-diene-1-carboxylic acid
SYSTEMATIC NAME: 3-[[4-[bis(2-chloroethyl)sulfamoyl]phenyl]hydrazinylidene]-6-oxidanylidene-cyclohexa-1,4-diene-1-carboxylic acid
MOLECULAR FORMULA: C17H17Cl2N3O5S
MOLECULAR WEIGHT: 446.30498
SMILES: C1=CC(=CC=C1NN=C2C=CC(=O)C(=C2)C(=O)O)S(=O)(=O)N(CCCl)CCCl
Structure:
CAS RN: 65624-35-3
CAS Name: 4-[[4-[bis(2-chloroethyl)sulfamoyl]phenyl]hydrazinylidene]-3-oxonaphthalene-2,7-disulfonic acid
OPENEYE Name: 4-[[4-[bis(2-chloroethyl)sulfamoyl]phenyl]hydrazono]-3-oxo-naphthalene-2,7-disulfonic acid
IUPAC Name: 4-[[4-[bis(2-chloroethyl)sulfamoyl]phenyl]hydrazinylidene]-3-oxonaphthalene-2,7-disulfonic acid
SYSTEMATIC NAME: 4-[[4-[bis(2-chloroethyl)sulfamoyl]phenyl]hydrazinylidene]-3-oxidanylidene-naphthalene-2,7-disulfonic acid
MOLECULAR FORMULA: C20H19Cl2N3O9S3
MOLECULAR WEIGHT: 612.48056
SMILES: C1=CC(=CC=C1NN=C2C3=C(C=C(C=C3)S(=O)(=O)O)C=C(C2=O)S(=O)(=O)O)S(=O)(=O)N(CCCl)CCCl
Structure:
CAS RN: 55164-40-4
CAS Name: (3Z)-3-(2-oxolanylidene)-2-oxolanone
OPENEYE Name: (3Z)-3-tetrahydrofuran-2-ylidenetetrahydrofuran-2-one
IUPAC Name: (3Z)-3-(oxolan-2-ylidene)oxolan-2-one
SYSTEMATIC NAME: (3Z)-3-(oxolan-2-ylidene)oxolan-2-one
MOLECULAR FORMULA: C8H10O3
MOLECULAR WEIGHT: 154.1632
SMILES: C1C/C(=C/2\CCOC2=O)/OC1
Structure:
CAS RN: 24571-99-1
CAS Name: (6E)-9-azabicyclo[6.2.0]dec-6-en-10-one
OPENEYE Name: (6E)-9-azabicyclo[6.2.0]dec-6-en-10-one
IUPAC Name: (6E)-9-azabicyclo[6.2.0]dec-6-en-10-one
SYSTEMATIC NAME: (6E)-9-azabicyclo[6.2.0]dec-6-en-10-one
MOLECULAR FORMULA: C9H13NO
MOLECULAR WEIGHT: 151.20562
SMILES: C1CCC2C(/C=C/C1)NC2=O
Structure:
CAS RN: 49695-24-1
CAS Name: 2,3-dimethyl-4-(phenylhydrazinylidene)-7-benzofuranone
OPENEYE Name: 2,3-dimethyl-4-(phenylhydrazono)benzofuran-7-one
IUPAC Name: 2,3-dimethyl-4-(phenylhydrazinylidene)-1-benzofuran-7-one
SYSTEMATIC NAME: 2,3-dimethyl-4-(phenylhydrazinylidene)-1-benzofuran-7-one
MOLECULAR FORMULA: C16H14N2O2
MOLECULAR WEIGHT: 266.29456
SMILES: CC1=C(OC2=C1C(=NNC3=CC=CC=C3)C=CC2=O)C
Structure:
CAS RN: 43149-46-8
CAS Name: (1Z)-1-(6-methyl-2-sulfanylidene-1H-pyrimidin-4-ylidene)-2-propanone
OPENEYE Name: (1Z)-1-(6-methyl-2-thioxo-1H-pyrimidin-4-ylidene)propan-2-one
IUPAC Name: (1Z)-1-(6-methyl-2-sulfanylidene-1H-pyrimidin-4-ylidene)propan-2-one
SYSTEMATIC NAME: (1Z)-1-(6-methyl-2-sulfanylidene-1H-pyrimidin-4-ylidene)propan-2-one
MOLECULAR FORMULA: C8H10N2OS
MOLECULAR WEIGHT: 182.2428
SMILES: CC1=C/C(=C/C(=O)C)/NC(=S)N1
Structure:
CAS RN: 49695-27-4
CAS Name: 4-ethyl-2,3-dimethyl-6-(phenylhydrazinylidene)-7-benzofuranone
OPENEYE Name: 4-ethyl-2,3-dimethyl-6-(phenylhydrazono)benzofuran-7-one
IUPAC Name: 4-ethyl-2,3-dimethyl-6-(phenylhydrazinylidene)-1-benzofuran-7-one
SYSTEMATIC NAME: 4-ethyl-2,3-dimethyl-6-(phenylhydrazinylidene)-1-benzofuran-7-one
MOLECULAR FORMULA: C18H18N2O2
MOLECULAR WEIGHT: 294.34772
SMILES: CCC1=CC(=NNC2=CC=CC=C2)C(=O)C3=C1C(=C(O3)C)C
Structure:
CAS RN: 78335-97-4
CAS Name: 3,4,6-trichloro-2-[(E)-2-nitroethenyl]phenol
OPENEYE Name: 3,4,6-trichloro-2-[(E)-2-nitrovinyl]phenol
IUPAC Name: 3,4,6-trichloro-2-[(E)-2-nitroethenyl]phenol
SYSTEMATIC NAME: 3,4,6-tris(chloranyl)-2-[(E)-2-nitroethenyl]phenol
MOLECULAR FORMULA: C8H4Cl3NO3
MOLECULAR WEIGHT: 268.48126
SMILES: C1=C(C(=C(C(=C1Cl)Cl)/C=C/[N+](=O)[O-])O)Cl
Structure:
CAS RN: 399-25-7
CAS Name: 1-fluoro-2-[(E)-2-nitroethenyl]benzene
OPENEYE Name: 1-fluoro-2-[(E)-2-nitrovinyl]benzene
IUPAC Name: 1-fluoro-2-[(E)-2-nitroethenyl]benzene
SYSTEMATIC NAME: 1-fluoranyl-2-[(E)-2-nitroethenyl]benzene
MOLECULAR FORMULA: C8H6FNO2
MOLECULAR WEIGHT: 167.137143
SMILES: C1=CC=C(C(=C1)/C=C/[N+](=O)[O-])F
Structure:
CAS RN: 38815-55-3
CAS Name: 1-bromo-2-[(E)-2-nitroethenyl]benzene
OPENEYE Name: 1-bromo-2-[(E)-2-nitrovinyl]benzene
IUPAC Name: 1-bromo-2-[(E)-2-nitroethenyl]benzene
SYSTEMATIC NAME: 1-bromanyl-2-[(E)-2-nitroethenyl]benzene
MOLECULAR FORMULA: C8H6BrNO2
MOLECULAR WEIGHT: 228.04274
SMILES: C1=CC=C(C(=C1)/C=C/[N+](=O)[O-])Br
Structure:
CAS RN: 65185-68-4
CAS Name: 1-bromo-2-[(E)-2-nitroethenyl]benzene
OPENEYE Name: 1-bromo-2-[(E)-2-nitrovinyl]benzene
IUPAC Name: 1-bromo-2-[(E)-2-nitroethenyl]benzene
SYSTEMATIC NAME: 1-bromanyl-2-[(E)-2-nitroethenyl]benzene
MOLECULAR FORMULA: C8H6BrNO2
MOLECULAR WEIGHT: 228.04274
SMILES: C1=CC=C(C(=C1)/C=C/[N+](=O)[O-])Br
Structure:
CAS RN: 37714-50-4
CAS Name: 6-methoxy-2,3-dimethyl-5-[(Z)-2-nitroethenyl]benzofuran
OPENEYE Name: 6-methoxy-2,3-dimethyl-5-[(Z)-2-nitrovinyl]benzofuran
IUPAC Name: 6-methoxy-2,3-dimethyl-5-[(Z)-2-nitroethenyl]-1-benzofuran
SYSTEMATIC NAME: 6-methoxy-2,3-dimethyl-5-[(Z)-2-nitroethenyl]-1-benzofuran
MOLECULAR FORMULA: C13H13NO4
MOLECULAR WEIGHT: 247.24662
SMILES: CC1=C(OC2=CC(=C(C=C12)/C=C\[N+](=O)[O-])OC)C
Structure:
CAS RN: 37714-51-5
CAS Name: 5-methoxy-2,3-dimethyl-6-[(E)-2-nitroethenyl]benzofuran
OPENEYE Name: 5-methoxy-2,3-dimethyl-6-[(E)-2-nitrovinyl]benzofuran
IUPAC Name: 5-methoxy-2,3-dimethyl-6-[(E)-2-nitroethenyl]-1-benzofuran
SYSTEMATIC NAME: 5-methoxy-2,3-dimethyl-6-[(E)-2-nitroethenyl]-1-benzofuran
MOLECULAR FORMULA: C13H13NO4
MOLECULAR WEIGHT: 247.24662
SMILES: CC1=C(OC2=CC(=C(C=C12)OC)/C=C/[N+](=O)[O-])C
Structure:
CAS RN: 37714-52-6
CAS Name: 7-methoxy-2,3-dimethyl-6-[(E)-2-nitroethenyl]benzofuran
OPENEYE Name: 7-methoxy-2,3-dimethyl-6-[(E)-2-nitrovinyl]benzofuran
IUPAC Name: 7-methoxy-2,3-dimethyl-6-[(E)-2-nitroethenyl]-1-benzofuran
SYSTEMATIC NAME: 7-methoxy-2,3-dimethyl-6-[(E)-2-nitroethenyl]-1-benzofuran
MOLECULAR FORMULA: C13H13NO4
MOLECULAR WEIGHT: 247.24662
SMILES: CC1=C(OC2=C1C=CC(=C2OC)/C=C/[N+](=O)[O-])C
Structure:
CAS RN: 1750-89-6
CAS Name: (6E)-6-[(2,2-diethylhydrazinyl)methylidene]-4-nitro-1-cyclohexa-2,4-dienone
OPENEYE Name: (6E)-6-[(2,2-diethylhydrazino)methylene]-4-nitro-cyclohexa-2,4-dien-1-one
IUPAC Name: (6E)-6-[(2,2-diethylhydrazinyl)methylidene]-4-nitrocyclohexa-2,4-dien-1-one
SYSTEMATIC NAME: (6E)-6-[(2,2-diethylhydrazinyl)methylidene]-4-nitro-cyclohexa-2,4-dien-1-one
MOLECULAR FORMULA: C11H15N3O3
MOLECULAR WEIGHT: 237.2551
SMILES: CCN(CC)N/C=C/1\C=C(C=CC1=O)[N+](=O)[O-]
Structure:
CAS RN: 92728-22-8
CAS Name: (6E)-6-[[2,2-bis(2-methylpropyl)hydrazinyl]methylidene]-4-nitro-1-cyclohexa-2,4-dienone
OPENEYE Name: (6E)-6-[(2,2-diisobutylhydrazino)methylene]-4-nitro-cyclohexa-2,4-dien-1-one
IUPAC Name: (6E)-6-[[2,2-bis(2-methylpropyl)hydrazinyl]methylidene]-4-nitrocyclohexa-2,4-dien-1-one
SYSTEMATIC NAME: (6E)-6-[[2,2-bis(2-methylpropyl)hydrazinyl]methylidene]-4-nitro-cyclohexa-2,4-dien-1-one
MOLECULAR FORMULA: C15H23N3O3
MOLECULAR WEIGHT: 293.36142
SMILES: CC(C)CN(CC(C)C)N/C=C/1\C=C(C=CC1=O)[N+](=O)[O-]
Structure:
CAS RN: 91643-76-4
CAS Name: 4-nitro-6-[(1-piperidinylamino)methylidene]-1-cyclohexa-2,4-dienone
OPENEYE Name: 4-nitro-6-[(1-piperidylamino)methylene]cyclohexa-2,4-dien-1-one
IUPAC Name: 4-nitro-6-[(piperidin-1-ylamino)methylidene]cyclohexa-2,4-dien-1-one
SYSTEMATIC NAME: 4-nitro-6-[(piperidin-1-ylamino)methylidene]cyclohexa-2,4-dien-1-one
MOLECULAR FORMULA: C12H15N3O3
MOLECULAR WEIGHT: 249.2658
SMILES: C1CCN(CC1)NC=C2C=C(C=CC2=O)[N+](=O)[O-]
Structure:
CAS RN: 17076-37-8
CAS Name: N-(3-indazolylideneamino)aniline
OPENEYE Name: N-(indazol-3-ylideneamino)aniline
IUPAC Name: N-(indazol-3-ylideneamino)aniline
SYSTEMATIC NAME: N-(indazol-3-ylideneamino)aniline
MOLECULAR FORMULA: C13H10N4
MOLECULAR WEIGHT: 222.2453
SMILES: C1=CC=C(C=C1)NN=C2C3=CC=CC=C3N=N2
Structure:
CAS RN: 42485-30-3
CAS Name: 5-[(3-bromo-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]-1H-pyrimidine-2,4-dione
OPENEYE Name: 5-[(3-bromo-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]-1H-pyrimidine-2,4-dione
IUPAC Name: 5-[(3-bromo-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]-1H-pyrimidine-2,4-dione
SYSTEMATIC NAME: 5-[(3-bromanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-1H-pyrimidine-2,4-dione
MOLECULAR FORMULA: C11H8BrN3O3
MOLECULAR WEIGHT: 310.10352
SMILES: C1=CC(=O)C(=CNC2=CNC(=O)NC2=O)C=C1Br
Structure:
CAS RN: 42485-26-7
CAS Name: 5-[(6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]-1H-pyrimidine-2,4-dione
OPENEYE Name: 5-[(6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]-1H-pyrimidine-2,4-dione
IUPAC Name: 5-[(6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]-1H-pyrimidine-2,4-dione
SYSTEMATIC NAME: 5-[(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)methylamino]-1H-pyrimidine-2,4-dione
MOLECULAR FORMULA: C11H9N3O3
MOLECULAR WEIGHT: 231.20746
SMILES: C1=CC(=CNC2=CNC(=O)NC2=O)C(=O)C=C1
Structure:
CAS RN: 35171-08-5
CAS Name: 4-[(7-amino-5-sulfanylidene-8H-pyrimido[5,4-e][1,2,4]triazin-3-yl)methylamino]benzoic acid ethyl ester
OPENEYE Name: ethyl 4-[(7-amino-5-thioxo-8H-pyrimido[5,4-e][1,2,4]triazin-3-yl)methylamino]benzoate
IUPAC Name: ethyl 4-[(7-amino-5-sulfanylidene-8H-pyrimido[5,4-e][1,2,4]triazin-3-yl)methylamino]benzoate
SYSTEMATIC NAME: ethyl 4-[(7-azanyl-5-sulfanylidene-8H-pyrimido[5,4-e][1,2,4]triazin-3-yl)methylamino]benzoate
MOLECULAR FORMULA: C15H15N7O2S
MOLECULAR WEIGHT: 357.3903
SMILES: CCOC(=O)C1=CC=C(C=C1)NCC2=NC3=C(NC(=NC3=S)N)N=N2
Structure:
CAS RN: 56763-56-5
CAS Name: (Z)-2,4-diphenyl-3-buten-2-ol
OPENEYE Name: (Z)-2,4-diphenylbut-3-en-2-ol
IUPAC Name: (Z)-2,4-diphenylbut-3-en-2-ol
SYSTEMATIC NAME: (Z)-2,4-diphenylbut-3-en-2-ol
MOLECULAR FORMULA: C16H16O
MOLECULAR WEIGHT: 224.29764
SMILES: CC(/C=C\C1=CC=CC=C1)(C2=CC=CC=C2)O
Structure:
CAS RN: 22965-99-7
CAS Name: (E)-3-(2-methoxyphenyl)-1-phenyl-2-propen-1-one
OPENEYE Name: (E)-3-(2-methoxyphenyl)-1-phenyl-prop-2-en-1-one
IUPAC Name: (E)-3-(2-methoxyphenyl)-1-phenylprop-2-en-1-one
SYSTEMATIC NAME: (E)-3-(2-methoxyphenyl)-1-phenyl-prop-2-en-1-one
MOLECULAR FORMULA: C16H14O2
MOLECULAR WEIGHT: 238.28116
SMILES: COC1=CC=CC=C1/C=C/C(=O)C2=CC=CC=C2
Structure:
CAS RN: 81226-96-2
CAS Name: (E)-3-(2-hydroxyphenyl)-1-(4-methylphenyl)-2-propen-1-one
OPENEYE Name: (E)-3-(2-hydroxyphenyl)-1-(p-tolyl)prop-2-en-1-one
IUPAC Name: (E)-3-(2-hydroxyphenyl)-1-(4-methylphenyl)prop-2-en-1-one
SYSTEMATIC NAME: (E)-3-(2-hydroxyphenyl)-1-(4-methylphenyl)prop-2-en-1-one
MOLECULAR FORMULA: C16H14O2
MOLECULAR WEIGHT: 238.28116
SMILES: CC1=CC=C(C=C1)C(=O)/C=C/C2=CC=CC=C2O
Structure:
CAS RN: 5320-35-4
CAS Name: 1-hydroxy-3-[(3,4,5-trimethoxyphenyl)methyl]-3,4-dihydrocyclohepta[c]pyran-8,9-dione
OPENEYE Name: 1-hydroxy-3-[(3,4,5-trimethoxyphenyl)methyl]-3,4-dihydrocyclohepta[c]pyran-8,9-dione
IUPAC Name: 1-hydroxy-3-[(3,4,5-trimethoxyphenyl)methyl]-3,4-dihydrocyclohepta[c]pyran-8,9-dione
SYSTEMATIC NAME: 1-oxidanyl-3-[(3,4,5-trimethoxyphenyl)methyl]-3,4-dihydrocyclohepta[c]pyran-8,9-dione
MOLECULAR FORMULA: C20H20O7
MOLECULAR WEIGHT: 372.3686
SMILES: COC1=CC(=CC(=C1OC)OC)CC2CC3=CC=CC(=O)C(=O)C3=C(O2)O
Structure:
CAS RN: 53338-45-7
CAS Name: 5,6-difluoro-2-(trifluoromethyl)-1H-imidazo[4,5-b]pyrazine
OPENEYE Name: 5,6-difluoro-2-(trifluoromethyl)-1H-imidazo[4,5-b]pyrazine
IUPAC Name: 5,6-difluoro-2-(trifluoromethyl)-1H-imidazo[4,5-b]pyrazine
SYSTEMATIC NAME: 5,6-bis(fluoranyl)-2-(trifluoromethyl)-1H-imidazo[4,5-b]pyrazine
MOLECULAR FORMULA: C6HF5N4
MOLECULAR WEIGHT: 224.090956
SMILES: C12=C(N=C(C(=N1)F)F)N=C(N2)C(F)(F)F
Structure:
CAS RN: 54955-14-5
CAS Name: 2-[(5Z,7E)-9-[[10-acetyloxy-6-hydroxy-5,9-dimethyl-7-oxo-1-[(E)-4-oxopent-2-en-2-yl]-8-benzo[f][1,3]benzodioxinyl]amino]-3-hydroxy-4,8-dimethyl-9-oxonona-5,7-dien-2-yl]-4,6-dihydroxy-5-methyl-3-oxanecarboxylic acid methyl ester
OPENEYE Name: methyl 2-[(4Z,6E)-8-[[10-acetoxy-6-hydroxy-5,9-dimethyl-1-[(E)-1-methyl-3-oxo-but-1-enyl]-7-oxo-benzo[f][1,3]benzodioxin-8-yl]amino]-2-hydroxy-1,3,7-trimethyl-8-oxo-octa-4,6-dienyl]-4,6-dihydroxy-5-methyl-tetrahydropyran-3-carboxylate
IUPAC Name: methyl 2-[(5Z,7E)-9-[[10-acetyloxy-6-hydroxy-5,9-dimethyl-7-oxo-1-[(E)-4-oxopent-2-en-2-yl]benzo[f][1,3]benzodioxin-8-yl]amino]-3-hydroxy-4,8-dimethyl-9-oxonona-5,7-dien-2-yl]-4,6-dihydroxy-5-methyloxane-3-carboxylate
SYSTEMATIC NAME: methyl 2-[(5Z,7E)-9-[[10-acetyloxy-5,9-dimethyl-6-oxidanyl-7-oxidanylidene-1-[(E)-4-oxidanylidenepent-2-en-2-yl]benzo[f][1,3]benzodioxin-8-yl]amino]-4,8-dimethyl-3-oxidanyl-9-oxidanylidene-nona-5,7-dien-2-yl]-5-methyl-4,6-bis(oxidanyl)oxane-3-carboxylate
MOLECULAR FORMULA: C40H49NO14
MOLECULAR WEIGHT: 767.81536
SMILES: CC1C(C(C(OC1O)C(C)C(C(C)/C=C\C=C(/C)\C(=O)NC2=C(C(=C3C(=C(C(=C4C3=C(OCO4)/C(=C/C(=O)C)/C)C)O)C2=O)OC(=O)C)C)O)C(=O)OC)O
Structure:
CAS RN: 1057-81-4
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C25H29NO5
MOLECULAR WEIGHT: 423.50146
SMILES: CN1CCC(CC1)OC2C3=CC=CC=C3CCC4=CC=CC=C24.C(=C\C(=O)O)\C(=O)O
Structure:
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