CAS RN: 139761-00-5
CAS Name: (2R,3R)-2,3-bis[(4-methylphenyl)-oxomethoxy]butanedioic acid; N-decan-4-ylcarbamic acid [(3aR,8bS)-8b-methyl-2,3,3a,4-tetrahydro-1H-indeno[2,1-b]pyrrol-7-yl] ester
OPENEYE Name: [(3aR,8bS)-8b-methyl-2,3,3a,4-tetrahydro-1H-indeno[2,1-b]pyrrol-7-yl] N-(1-propylheptyl)carbamate; (2R,3R)-2,3-bis[(4-methylbenzoyl)oxy]butanedioic acid
IUPAC Name: [(3aR,8bS)-8b-methyl-2,3,3a,4-tetrahydro-1H-indeno[2,1-b]pyrrol-7-yl] N-decan-4-ylcarbamate; (2R,3R)-2,3-bis[(4-methylbenzoyl)oxy]butanedioic acid
SYSTEMATIC NAME: [(3aR,8bS)-8b-methyl-2,3,3a,4-tetrahydro-1H-indeno[2,1-b]pyrrol-7-yl] N-decan-4-ylcarbamate; (2R,3R)-2,3-bis[(4-methylphenyl)carbonyloxy]butanedioic acid
MOLECULAR FORMULA: C43H54N2O10
MOLECULAR WEIGHT: 758.89626
SMILES: CCCCCCC(CCC)NC(=O)OC1=CC2=C(C[C@@H]3[C@]2(CCN3)C)C=C1.CC1=CC=C(C=C1)C(=O)O[C@H]([C@H](C(=O)O)OC(=O)C2=CC=C(C=C2)C)C(=O)O
Structure:
CAS RN: 139760-98-8
CAS Name: (2R,3R)-2,3-bis[(4-methylphenyl)-oxomethoxy]butanedioic acid; N-(phenylmethyl)carbamic acid [(3aR,8bS)-3-ethyl-8b-methyl-1,2,3a,4-tetrahydroindeno[2,1-b]pyrrol-6-yl] ester
OPENEYE Name: [(3aR,8bS)-3-ethyl-8b-methyl-1,2,3a,4-tetrahydroindeno[2,1-b]pyrrol-6-yl] N-benzylcarbamate; (2R,3R)-2,3-bis[(4-methylbenzoyl)oxy]butanedioic acid
IUPAC Name: [(3aR,8bS)-3-ethyl-8b-methyl-1,2,3a,4-tetrahydroindeno[2,1-b]pyrrol-6-yl] N-benzylcarbamate; (2R,3R)-2,3-bis[(4-methylbenzoyl)oxy]butanedioic acid
SYSTEMATIC NAME: [(3aR,8bS)-3-ethyl-8b-methyl-1,2,3a,4-tetrahydroindeno[2,1-b]pyrrol-6-yl] N-(phenylmethyl)carbamate; (2R,3R)-2,3-bis[(4-methylphenyl)carbonyloxy]butanedioic acid
MOLECULAR FORMULA: C42H44N2O10
MOLECULAR WEIGHT: 736.80616
SMILES: CCN1CC[C@@]2([C@H]1CC3=C2C=CC(=C3)OC(=O)NCC4=CC=CC=C4)C.CC1=CC=C(C=C1)C(=O)O[C@H]([C@H](C(=O)O)OC(=O)C2=CC=C(C=C2)C)C(=O)O
Structure:
CAS RN: 139760-93-3
CAS Name: [(3aR,8bS)-8b-methyl-2,3,3a,4-tetrahydro-1H-indeno[2,1-b]pyrrol-7-yl]-propylcarbamic acid; (2R,3R)-2,3-bis[(4-methylphenyl)-oxomethoxy]butanedioic acid
OPENEYE Name: [(3aR,8bS)-8b-methyl-2,3,3a,4-tetrahydro-1H-indeno[2,1-b]pyrrol-7-yl]-propyl-carbamic acid; (2R,3R)-2,3-bis[(4-methylbenzoyl)oxy]butanedioic acid
IUPAC Name: [(3aR,8bS)-8b-methyl-2,3,3a,4-tetrahydro-1H-indeno[2,1-b]pyrrol-7-yl]-propylcarbamic acid; (2R,3R)-2,3-bis[(4-methylbenzoyl)oxy]butanedioic acid
SYSTEMATIC NAME: [(3aR,8bS)-8b-methyl-2,3,3a,4-tetrahydro-1H-indeno[2,1-b]pyrrol-7-yl]-propyl-carbamic acid; (2R,3R)-2,3-bis[(4-methylphenyl)carbonyloxy]butanedioic acid
MOLECULAR FORMULA: C36H40N2O10
MOLECULAR WEIGHT: 660.7102
SMILES: CCCN(C1=CC2=C(C[C@@H]3[C@]2(CCN3)C)C=C1)C(=O)O.CC1=CC=C(C=C1)C(=O)O[C@H]([C@H](C(=O)O)OC(=O)C2=CC=C(C=C2)C)C(=O)O
Structure:
CAS RN: 139760-91-1
CAS Name: [(3aR,8bS)-8b-methyl-2,3,3a,4-tetrahydro-1H-indeno[2,1-b]pyrrol-7-yl]-pentan-3-ylcarbamic acid; (2R,3R)-2,3-bis[(4-methylphenyl)-oxomethoxy]butanedioic acid
OPENEYE Name: [(3aR,8bS)-8b-methyl-2,3,3a,4-tetrahydro-1H-indeno[2,1-b]pyrrol-7-yl]-(1-ethylpropyl)carbamic acid; (2R,3R)-2,3-bis[(4-methylbenzoyl)oxy]butanedioic acid
IUPAC Name: [(3aR,8bS)-8b-methyl-2,3,3a,4-tetrahydro-1H-indeno[2,1-b]pyrrol-7-yl]-pentan-3-ylcarbamic acid; (2R,3R)-2,3-bis[(4-methylbenzoyl)oxy]butanedioic acid
SYSTEMATIC NAME: [(3aR,8bS)-8b-methyl-2,3,3a,4-tetrahydro-1H-indeno[2,1-b]pyrrol-7-yl]-pentan-3-yl-carbamic acid; (2R,3R)-2,3-bis[(4-methylphenyl)carbonyloxy]butanedioic acid
MOLECULAR FORMULA: C38H44N2O10
MOLECULAR WEIGHT: 688.76336
SMILES: CCC(CC)N(C1=CC2=C(C[C@@H]3[C@]2(CCN3)C)C=C1)C(=O)O.CC1=CC=C(C=C1)C(=O)O[C@H]([C@H](C(=O)O)OC(=O)C2=CC=C(C=C2)C)C(=O)O
Structure:
CAS RN: 139760-89-7
CAS Name: N-tert-butylcarbamic acid [(3aR,8bS)-3-ethyl-8b-methyl-1,2,3a,4-tetrahydroindeno[2,1-b]pyrrol-7-yl] ester
OPENEYE Name: [(3aR,8bS)-3-ethyl-8b-methyl-1,2,3a,4-tetrahydroindeno[2,1-b]pyrrol-7-yl] N-tert-butylcarbamate
IUPAC Name: [(3aR,8bS)-3-ethyl-8b-methyl-1,2,3a,4-tetrahydroindeno[2,1-b]pyrrol-7-yl] N-tert-butylcarbamate
SYSTEMATIC NAME: [(3aR,8bS)-3-ethyl-8b-methyl-1,2,3a,4-tetrahydroindeno[2,1-b]pyrrol-7-yl] N-tert-butylcarbamate
MOLECULAR FORMULA: C19H28N2O2
MOLECULAR WEIGHT: 316.43782
SMILES: CCN1CC[C@@]2([C@H]1CC3=C2C=C(C=C3)OC(=O)NC(C)(C)C)C
Structure:
CAS RN: 139760-88-6
CAS Name: [(3aR,8bS)-8b-methyl-2,3,3a,4-tetrahydro-1H-indeno[2,1-b]pyrrol-7-yl]-hexan-3-ylcarbamic acid; (2R,3R)-2,3-bis[(4-methylphenyl)-oxomethoxy]butanedioic acid
OPENEYE Name: [(3aR,8bS)-8b-methyl-2,3,3a,4-tetrahydro-1H-indeno[2,1-b]pyrrol-7-yl]-(1-ethylbutyl)carbamic acid; (2R,3R)-2,3-bis[(4-methylbenzoyl)oxy]butanedioic acid
IUPAC Name: [(3aR,8bS)-8b-methyl-2,3,3a,4-tetrahydro-1H-indeno[2,1-b]pyrrol-7-yl]-hexan-3-ylcarbamic acid; (2R,3R)-2,3-bis[(4-methylbenzoyl)oxy]butanedioic acid
SYSTEMATIC NAME: [(3aR,8bS)-8b-methyl-2,3,3a,4-tetrahydro-1H-indeno[2,1-b]pyrrol-7-yl]-hexan-3-yl-carbamic acid; (2R,3R)-2,3-bis[(4-methylphenyl)carbonyloxy]butanedioic acid
MOLECULAR FORMULA: C39H46N2O10
MOLECULAR WEIGHT: 702.78994
SMILES: CCCC(CC)N(C1=CC2=C(C[C@@H]3[C@]2(CCN3)C)C=C1)C(=O)O.CC1=CC=C(C=C1)C(=O)O[C@H]([C@H](C(=O)O)OC(=O)C2=CC=C(C=C2)C)C(=O)O
Structure:
CAS RN: 139760-84-2
CAS Name: [(3aR,8bS)-8b-methyl-2,3,3a,4-tetrahydro-1H-indeno[2,1-b]pyrrol-7-yl]-nonan-3-ylcarbamic acid; (2R,3R)-2,3-bis[(4-methylphenyl)-oxomethoxy]butanedioic acid
OPENEYE Name: [(3aR,8bS)-8b-methyl-2,3,3a,4-tetrahydro-1H-indeno[2,1-b]pyrrol-7-yl]-(1-ethylheptyl)carbamic acid; (2R,3R)-2,3-bis[(4-methylbenzoyl)oxy]butanedioic acid
IUPAC Name: [(3aR,8bS)-8b-methyl-2,3,3a,4-tetrahydro-1H-indeno[2,1-b]pyrrol-7-yl]-nonan-3-ylcarbamic acid; (2R,3R)-2,3-bis[(4-methylbenzoyl)oxy]butanedioic acid
SYSTEMATIC NAME: [(3aR,8bS)-8b-methyl-2,3,3a,4-tetrahydro-1H-indeno[2,1-b]pyrrol-7-yl]-nonan-3-yl-carbamic acid; (2R,3R)-2,3-bis[(4-methylphenyl)carbonyloxy]butanedioic acid
MOLECULAR FORMULA: C42H52N2O10
MOLECULAR WEIGHT: 744.86968
SMILES: CCCCCCC(CC)N(C1=CC2=C(C[C@@H]3[C@]2(CCN3)C)C=C1)C(=O)O.CC1=CC=C(C=C1)C(=O)O[C@H]([C@H](C(=O)O)OC(=O)C2=CC=C(C=C2)C)C(=O)O
Structure:
CAS RN: 139760-82-0
CAS Name: [(3aR,8bS)-8b-methyl-2,3,3a,4-tetrahydro-1H-indeno[2,1-b]pyrrol-7-yl]-heptan-2-ylcarbamic acid; (2R,3R)-2,3-bis[(4-methylphenyl)-oxomethoxy]butanedioic acid
OPENEYE Name: [(3aR,8bS)-8b-methyl-2,3,3a,4-tetrahydro-1H-indeno[2,1-b]pyrrol-7-yl]-(1-methylhexyl)carbamic acid; (2R,3R)-2,3-bis[(4-methylbenzoyl)oxy]butanedioic acid
IUPAC Name: [(3aR,8bS)-8b-methyl-2,3,3a,4-tetrahydro-1H-indeno[2,1-b]pyrrol-7-yl]-heptan-2-ylcarbamic acid; (2R,3R)-2,3-bis[(4-methylbenzoyl)oxy]butanedioic acid
SYSTEMATIC NAME: [(3aR,8bS)-8b-methyl-2,3,3a,4-tetrahydro-1H-indeno[2,1-b]pyrrol-7-yl]-heptan-2-yl-carbamic acid; (2R,3R)-2,3-bis[(4-methylphenyl)carbonyloxy]butanedioic acid
MOLECULAR FORMULA: C40H48N2O10
MOLECULAR WEIGHT: 716.81652
SMILES: CCCCCC(C)N(C1=CC2=C(C[C@@H]3[C@]2(CCN3)C)C=C1)C(=O)O.CC1=CC=C(C=C1)C(=O)O[C@H]([C@H](C(=O)O)OC(=O)C2=CC=C(C=C2)C)C(=O)O
Structure:
CAS RN: 139760-80-8
CAS Name: [(3aR,8bS)-8b-methyl-2,3,3a,4-tetrahydro-1H-indeno[2,1-b]pyrrol-7-yl]-octan-2-ylcarbamic acid; (2R,3R)-2,3-bis[(4-methylphenyl)-oxomethoxy]butanedioic acid
OPENEYE Name: [(3aR,8bS)-8b-methyl-2,3,3a,4-tetrahydro-1H-indeno[2,1-b]pyrrol-7-yl]-(1-methylheptyl)carbamic acid; (2R,3R)-2,3-bis[(4-methylbenzoyl)oxy]butanedioic acid
IUPAC Name: [(3aR,8bS)-8b-methyl-2,3,3a,4-tetrahydro-1H-indeno[2,1-b]pyrrol-7-yl]-octan-2-ylcarbamic acid; (2R,3R)-2,3-bis[(4-methylbenzoyl)oxy]butanedioic acid
SYSTEMATIC NAME: [(3aR,8bS)-8b-methyl-2,3,3a,4-tetrahydro-1H-indeno[2,1-b]pyrrol-7-yl]-octan-2-yl-carbamic acid; (2R,3R)-2,3-bis[(4-methylphenyl)carbonyloxy]butanedioic acid
MOLECULAR FORMULA: C41H50N2O10
MOLECULAR WEIGHT: 730.8431
SMILES: CCCCCCC(C)N(C1=CC2=C(C[C@@H]3[C@]2(CCN3)C)C=C1)C(=O)O.CC1=CC=C(C=C1)C(=O)O[C@H]([C@H](C(=O)O)OC(=O)C2=CC=C(C=C2)C)C(=O)O
Structure:
CAS RN: 139755-24-1
CAS Name: 3-(4-chlorophenyl)-1-[(2,4-dimethoxyphenyl)methyl]-2-methyl-4-quinazolin-1-iumone perchlorate
OPENEYE Name: 3-(4-chlorophenyl)-1-[(2,4-dimethoxyphenyl)methyl]-2-methyl-quinazolin-1-ium-4-one perchlorate
IUPAC Name: 3-(4-chlorophenyl)-1-[(2,4-dimethoxyphenyl)methyl]-2-methylquinazolin-1-ium-4-one perchlorate
SYSTEMATIC NAME: 3-(4-chlorophenyl)-1-[(2,4-dimethoxyphenyl)methyl]-2-methyl-quinazolin-1-ium-4-one perchlorate
MOLECULAR FORMULA: C24H22Cl2N2O7
MOLECULAR WEIGHT: 521.34668
SMILES: CC1=[N+](C2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)Cl)CC4=C(C=C(C=C4)OC)OC.[O-]Cl(=O)(=O)=O
Structure:
CAS RN: 139670-61-4
CAS Name: 6-fluoro-2,3-dihydrothiazolo[3,2-a]pyrimidin-5-one
OPENEYE Name: 6-fluoro-2,3-dihydrothiazolo[3,2-a]pyrimidin-5-one
IUPAC Name: 6-fluoro-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-5-one
SYSTEMATIC NAME: 6-fluoranyl-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-5-one
MOLECULAR FORMULA: C6H5FN2OS
MOLECULAR WEIGHT: 172.180103
SMILES: C1CSC2=NC=C(C(=O)N21)F
Structure:
CAS RN: 139636-03-6
CAS Name: 2,6-dichloro-1-[(1R,4R,5R,6S)-5,6-dihydroxy-3-(hydroxymethyl)-4-methoxy-1-cyclohex-2-enyl]-5-hydroxy-8-methyl-4-[1]benzopyrano[2,3-b]pyrrolone
OPENEYE Name: 2,6-dichloro-1-[(1R,4R,5R,6S)-5,6-dihydroxy-3-(hydroxymethyl)-4-methoxy-cyclohex-2-en-1-yl]-5-hydroxy-8-methyl-chromeno[2,3-b]pyrrol-4-one
IUPAC Name: 2,6-dichloro-1-[(1R,4R,5R,6S)-5,6-dihydroxy-3-(hydroxymethyl)-4-methoxycyclohex-2-en-1-yl]-5-hydroxy-8-methylchromeno[2,3-b]pyrrol-4-one
SYSTEMATIC NAME: 2,6-bis(chloranyl)-1-[(1R,4R,5R,6S)-3-(hydroxymethyl)-4-methoxy-5,6-bis(oxidanyl)cyclohex-2-en-1-yl]-8-methyl-5-oxidanyl-chromeno[2,3-b]pyrrol-4-one
MOLECULAR FORMULA: C20H19Cl2NO7
MOLECULAR WEIGHT: 456.27336
SMILES: CC1=CC(=C(C2=C1OC3=C(C2=O)C=C(N3[C@@H]4C=C([C@H]([C@@H]([C@H]4O)O)OC)CO)Cl)O)Cl
Structure:
CAS RN: 139636-00-3
CAS Name: 2,6-dichloro-1-[(2R,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-methoxy-2-oxanyl]-5-hydroxy-8-methyl-4-[1]benzopyrano[2,3-b]pyrrolone
OPENEYE Name: 2,6-dichloro-1-[(2R,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-methoxy-tetrahydropyran-2-yl]-5-hydroxy-8-methyl-chromeno[2,3-b]pyrrol-4-one
IUPAC Name: 2,6-dichloro-1-[(2R,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-methoxyoxan-2-yl]-5-hydroxy-8-methylchromeno[2,3-b]pyrrol-4-one
SYSTEMATIC NAME: 2,6-bis(chloranyl)-1-[(2R,3R,4R,5S,6R)-6-(hydroxymethyl)-5-methoxy-3,4-bis(oxidanyl)oxan-2-yl]-8-methyl-5-oxidanyl-chromeno[2,3-b]pyrrol-4-one
MOLECULAR FORMULA: C19H19Cl2NO8
MOLECULAR WEIGHT: 460.26206
SMILES: CC1=CC(=C(C2=C1OC3=C(C2=O)C=C(N3[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)OC)O)O)Cl)O)Cl
Structure:
CAS RN: 139617-46-2
CAS Name: 1-[4-phenyl-5-(phenylmethyl)-5-(1-piperidinyl)-1,3,4-thiadiazol-2-yl]ethanone
OPENEYE Name: 1-[5-benzyl-4-phenyl-5-(1-piperidyl)-1,3,4-thiadiazol-2-yl]ethanone
IUPAC Name: 1-(5-benzyl-4-phenyl-5-piperidin-1-yl-1,3,4-thiadiazol-2-yl)ethanone
SYSTEMATIC NAME: 1-[4-phenyl-5-(phenylmethyl)-5-piperidin-1-yl-1,3,4-thiadiazol-2-yl]ethanone
MOLECULAR FORMULA: C22H25N3OS
MOLECULAR WEIGHT: 379.5184
SMILES: CC(=O)C1=NN(C(S1)(CC2=CC=CC=C2)N3CCCCC3)C4=CC=CC=C4
Structure:
CAS RN: 139605-59-7
CAS Name: 5-methyl-3,5-dihydro-1H-[1,2,4]triazino[3,4-c][1,4]benzothiazin-2-one
OPENEYE Name: 5-methyl-3,5-dihydro-1H-[1,2,4]triazino[3,4-c][1,4]benzothiazin-2-one
IUPAC Name: 5-methyl-3,5-dihydro-1H-[1,2,4]triazino[3,4-c][1,4]benzothiazin-2-one
SYSTEMATIC NAME: 5-methyl-3,5-dihydro-1H-[1,2,4]triazino[3,4-c][1,4]benzothiazin-2-one
MOLECULAR FORMULA: C11H11N3OS
MOLECULAR WEIGHT: 233.28954
SMILES: CC1C2=NNC(=O)CN2C3=CC=CC=C3S1
Structure:
CAS RN: 139605-58-6
CAS Name: 7-nitro-3,5-dihydro-1H-[1,2,4]triazino[3,4-c][1,4]benzothiazin-2-one
OPENEYE Name: 7-nitro-3,5-dihydro-1H-[1,2,4]triazino[3,4-c][1,4]benzothiazin-2-one
IUPAC Name: 7-nitro-3,5-dihydro-1H-[1,2,4]triazino[3,4-c][1,4]benzothiazin-2-one
SYSTEMATIC NAME: 7-nitro-3,5-dihydro-1H-[1,2,4]triazino[3,4-c][1,4]benzothiazin-2-one
MOLECULAR FORMULA: C10H8N4O3S
MOLECULAR WEIGHT: 264.26052
SMILES: C1C(=O)NN=C2N1C3=C(C(=CC=C3)[N+](=O)[O-])SC2
Structure:
CAS RN: 139605-57-5
CAS Name: 7-methyl-3,5-dihydro-1H-[1,2,4]triazino[3,4-c][1,4]benzothiazin-2-one
OPENEYE Name: 7-methyl-3,5-dihydro-1H-[1,2,4]triazino[3,4-c][1,4]benzothiazin-2-one
IUPAC Name: 7-methyl-3,5-dihydro-1H-[1,2,4]triazino[3,4-c][1,4]benzothiazin-2-one
SYSTEMATIC NAME: 7-methyl-3,5-dihydro-1H-[1,2,4]triazino[3,4-c][1,4]benzothiazin-2-one
MOLECULAR FORMULA: C11H11N3OS
MOLECULAR WEIGHT: 233.28954
SMILES: CC1=C2C(=CC=C1)N3CC(=O)NN=C3CS2
Structure:
CAS RN: 139605-56-4
CAS Name: 3,5-dihydro-1H-[1,2,4]triazino[3,4-c][1,4]benzothiazin-2-one
OPENEYE Name: 3,5-dihydro-1H-[1,2,4]triazino[3,4-c][1,4]benzothiazin-2-one
IUPAC Name: 3,5-dihydro-1H-[1,2,4]triazino[3,4-c][1,4]benzothiazin-2-one
SYSTEMATIC NAME: 3,5-dihydro-1H-[1,2,4]triazino[3,4-c][1,4]benzothiazin-2-one
MOLECULAR FORMULA: C10H9N3OS
MOLECULAR WEIGHT: 219.26296
SMILES: C1C(=O)NN=C2N1C3=CC=CC=C3SC2
Structure:
CAS RN: 139605-55-3
CAS Name: 5-methyl-3,5-dihydro-1H-[1,2,4]triazino[3,4-c][1,4]benzoxazin-2-one
OPENEYE Name: 5-methyl-3,5-dihydro-1H-[1,2,4]triazino[3,4-c][1,4]benzoxazin-2-one
IUPAC Name: 5-methyl-3,5-dihydro-1H-[1,2,4]triazino[3,4-c][1,4]benzoxazin-2-one
SYSTEMATIC NAME: 5-methyl-3,5-dihydro-1H-[1,2,4]triazino[3,4-c][1,4]benzoxazin-2-one
MOLECULAR FORMULA: C11H11N3O2
MOLECULAR WEIGHT: 217.22394
SMILES: CC1C2=NNC(=O)CN2C3=CC=CC=C3O1
Structure:
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