Product OPENEYE NAME: [7-(sulfonatomethyl)-3,8-phenanthrolin-4-yl]methanesulfonate
CAS Name: [7-(sulfonatomethyl)-3,8-phenanthrolin-4-yl]methanesulfonate
IUPAC NAME: [7-(sulfonatomethyl)-3,8-phenanthrolin-4-yl]methanesulfonate
SYSTEMATIC NAME: [7-(sulfonatomethyl)-3,8-phenanthrolin-4-yl]methanesulfonate
MOLECULAR FORMULA: C14H10N2O6S2-2
MOLECULAR WEIGHT: 366.369
SMILES: C1=CC2=C(C=CN=C2CS(=O)(=O)[O-])C3=C1C(=NC=C3)CS(=O)(=O)[O-]
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Product OPENEYE NAME: ethyl 3-(2,2-diethoxyvinylamino)-3-[4-[1-(2,2-diethoxyvinylamino)-3-ethoxy-3-oxo-propyl]phenyl]propanoate
CAS Name: 3-(2,2-diethoxyethenylamino)-3-[4-[1-(2,2-diethoxyethenylamino)-3-ethoxy-3-oxopropyl]phenyl]propanoic acid ethyl ester
IUPAC NAME: ethyl 3-(2,2-diethoxyethenylamino)-3-[4-[1-(2,2-diethoxyethenylamino)-3-ethoxy-3-oxopropyl]phenyl]propanoate
SYSTEMATIC NAME: ethyl 3-(2,2-diethoxyethenylamino)-3-[4-[1-(2,2-diethoxyethenylamino)-3-ethoxy-3-oxidanylidene-propyl]phenyl]propanoate
MOLECULAR FORMULA: C28H44N2O8
MOLECULAR WEIGHT: 536.65756
SMILES: CCOC(=O)CC(C1=CC=C(C=C1)C(CC(=O)OCC)NC=C(OCC)OCC)NC=C(OCC)OCC
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Product OPENEYE NAME: S-(3,4-dimethoxyphenyl) 3-methylbut-2-enethioate
CAS Name: 3-methyl-2-butenethioic acid S-(3,4-dimethoxyphenyl) ester
IUPAC NAME: S-(3,4-dimethoxyphenyl) 3-methylbut-2-enethioate
SYSTEMATIC NAME: S-(3,4-dimethoxyphenyl) 3-methylbut-2-enethioate
MOLECULAR FORMULA: C13H16O3S
MOLECULAR WEIGHT: 252.32934
SMILES: CC(=CC(=O)SC1=CC(=C(C=C1)OC)OC)C
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Product OPENEYE NAME: 5-methoxy-2,2-dimethyl-thiochroman-4-one
CAS Name: 5-methoxy-2,2-dimethyl-3H-1-benzothiopyran-4-one
IUPAC NAME: 5-methoxy-2,2-dimethyl-3H-thiochromen-4-one
SYSTEMATIC NAME: 5-methoxy-2,2-dimethyl-3H-thiochromen-4-one
MOLECULAR FORMULA: C12H14O2S
MOLECULAR WEIGHT: 222.30336
SMILES: CC1(CC(=O)C2=C(C=CC=C2S1)OC)C
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Product OPENEYE NAME: 3-[(Z)-styryl]benzo[g]benzothiophene
CAS Name: 3-[(Z)-2-phenylethenyl]benzo[g][1]benzothiole
IUPAC NAME: 3-[(Z)-2-phenylethenyl]benzo[g][1]benzothiole
SYSTEMATIC NAME: 3-[(Z)-2-phenylethenyl]benzo[g][1]benzothiole
MOLECULAR FORMULA: C20H14S
MOLECULAR WEIGHT: 286.39016
SMILES: C1=CC=C(C=C1)/C=C\C2=CSC3=C2C=CC4=CC=CC=C43
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Product OPENEYE NAME: 2-(9-methyldibenzothiophen-1-yl)acetonitrile
CAS Name: 2-(9-methyl-1-dibenzothiophenyl)acetonitrile
IUPAC NAME: 2-(9-methyldibenzothiophen-1-yl)acetonitrile
SYSTEMATIC NAME: 2-(9-methyldibenzothiophen-1-yl)ethanenitrile
MOLECULAR FORMULA: C15H11NS
MOLECULAR WEIGHT: 237.31954
SMILES: CC1=C2C(=CC=C1)SC3=CC=CC(=C32)CC#N
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Product OPENEYE NAME: 2-(9-methyldibenzothiophen-1-yl)acetaldehyde
CAS Name: 2-(9-methyl-1-dibenzothiophenyl)acetaldehyde
IUPAC NAME: 2-(9-methyldibenzothiophen-1-yl)acetaldehyde
SYSTEMATIC NAME: 2-(9-methyldibenzothiophen-1-yl)ethanal
MOLECULAR FORMULA: C15H12OS
MOLECULAR WEIGHT: 240.32018
SMILES: CC1=C2C(=CC=C1)SC3=CC=CC(=C32)CC=O
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Product OPENEYE NAME: (2E)-6-methyl-2-(6-oxocyclohexa-2,4-dien-1-ylidene)-1H-quinazolin-4-one
CAS Name: (2E)-6-methyl-2-(6-oxo-1-cyclohexa-2,4-dienylidene)-1H-quinazolin-4-one
IUPAC NAME: (2E)-6-methyl-2-(6-oxocyclohexa-2,4-dien-1-ylidene)-1H-quinazolin-4-one
SYSTEMATIC NAME: (2E)-6-methyl-2-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-1H-quinazolin-4-one
MOLECULAR FORMULA: C15H12N2O2
MOLECULAR WEIGHT: 252.26798
SMILES: CC1=CC2=C(C=C1)N/C(=C\3/C=CC=CC3=O)/NC2=O
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Product OPENEYE NAME: (2E)-6-chloro-2-(6-oxocyclohexa-2,4-dien-1-ylidene)-1H-quinazolin-4-one
CAS Name: (2E)-6-chloro-2-(6-oxo-1-cyclohexa-2,4-dienylidene)-1H-quinazolin-4-one
IUPAC NAME: (2E)-6-chloro-2-(6-oxocyclohexa-2,4-dien-1-ylidene)-1H-quinazolin-4-one
SYSTEMATIC NAME: (2E)-6-chloranyl-2-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-1H-quinazolin-4-one
MOLECULAR FORMULA: C14H9ClN2O2
MOLECULAR WEIGHT: 272.68646
SMILES: C1=C/C(=C\2/NC3=C(C=C(C=C3)Cl)C(=O)N2)/C(=O)C=C1
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Product OPENEYE NAME: 2-(2-amino-2-oxo-ethoxy)ethyl benzoate
CAS Name: benzoic acid 2-(2-amino-2-oxoethoxy)ethyl ester
IUPAC NAME: 2-(2-amino-2-oxoethoxy)ethyl benzoate
SYSTEMATIC NAME: 2-(2-azanyl-2-oxidanylidene-ethoxy)ethyl benzoate
MOLECULAR FORMULA: C11H13NO4
MOLECULAR WEIGHT: 223.22522
SMILES: C1=CC=C(C=C1)C(=O)OCCOCC(=O)N
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Product OPENEYE NAME: 2-[2-[(2,6-diamino-4-oxo-1H-pyrimidin-5-yl)amino]-2-oxo-ethoxy]ethyl benzoate
CAS Name: benzoic acid 2-[2-[(2,6-diamino-4-oxo-1H-pyrimidin-5-yl)amino]-2-oxoethoxy]ethyl ester
IUPAC NAME: 2-[2-[(2,6-diamino-4-oxo-1H-pyrimidin-5-yl)amino]-2-oxoethoxy]ethyl benzoate
SYSTEMATIC NAME: 2-[2-[[2,6-bis(azanyl)-4-oxidanylidene-1H-pyrimidin-5-yl]amino]-2-oxidanylidene-ethoxy]ethyl benzoate
MOLECULAR FORMULA: C15H17N5O5
MOLECULAR WEIGHT: 347.32598
SMILES: C1=CC=C(C=C1)C(=O)OCCOCC(=O)NC2=C(NC(=NC2=O)N)N
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Product OPENEYE NAME: N-(2,6-diamino-4-oxo-1H-pyrimidin-5-yl)-2-(2-hydroxyethoxy)acetamide
CAS Name: N-(2,6-diamino-4-oxo-1H-pyrimidin-5-yl)-2-(2-hydroxyethoxy)acetamide
IUPAC NAME: N-(2,6-diamino-4-oxo-1H-pyrimidin-5-yl)-2-(2-hydroxyethoxy)acetamide
SYSTEMATIC NAME: N-[2,6-bis(azanyl)-4-oxidanylidene-1H-pyrimidin-5-yl]-2-(2-hydroxyethyloxy)ethanamide
MOLECULAR FORMULA: C8H13N5O4
MOLECULAR WEIGHT: 243.21992
SMILES: C(COCC(=O)NC1=C(NC(=NC1=O)N)N)O
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Product OPENEYE NAME: 2-[(8-nitro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)methoxy]ethyl benzoate
CAS Name: benzoic acid 2-[(8-nitro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)methoxy]ethyl ester
IUPAC NAME: 2-[(8-nitro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)methoxy]ethyl benzoate
SYSTEMATIC NAME: 2-[(8-nitro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)methoxy]ethyl benzoate
MOLECULAR FORMULA: C16H14N4O5
MOLECULAR WEIGHT: 342.30616
SMILES: C1=CC=C(C=C1)C(=O)OCCOCC2=NN3C=CC=C(C3=N2)[N+](=O)[O-]
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Product OPENEYE NAME: 2-[(8-amino-[1,2,4]triazolo[1,5-a]pyridin-2-yl)methoxy]ethyl benzoate
CAS Name: benzoic acid 2-[(8-amino-[1,2,4]triazolo[1,5-a]pyridin-2-yl)methoxy]ethyl ester
IUPAC NAME: 2-[(8-amino-[1,2,4]triazolo[1,5-a]pyridin-2-yl)methoxy]ethyl benzoate
SYSTEMATIC NAME: 2-[(8-azanyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)methoxy]ethyl benzoate
MOLECULAR FORMULA: C16H16N4O3
MOLECULAR WEIGHT: 312.32324
SMILES: C1=CC=C(C=C1)C(=O)OCCOCC2=NN3C=CC=C(C3=N2)N
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