Product OPENEYE NAME: 4-[2-[(2R)-2-[(E,3R)-3-hydroxy-4,4-dimethyl-oct-1-enyl]-5-oxo-pyrrolidin-1-yl]ethyl]benzoic acid
CAS Name: 4-[2-[(2R)-2-[(E,3R)-3-hydroxy-4,4-dimethyloct-1-enyl]-5-oxo-1-pyrrolidinyl]ethyl]benzoic acid
IUPAC NAME: 4-[2-[(2R)-2-[(E,3R)-3-hydroxy-4,4-dimethyloct-1-enyl]-5-oxopyrrolidin-1-yl]ethyl]benzoic acid
SYSTEMATIC NAME: 4-[2-[(2R)-2-[(E,3R)-4,4-dimethyl-3-oxidanyl-oct-1-enyl]-5-oxidanylidene-pyrrolidin-1-yl]ethyl]benzoic acid
MOLECULAR FORMULA: C23H33NO4
MOLECULAR WEIGHT: 387.51242
SMILES: CCCCC(C)(C)[C@@H](/C=C/[C@H]1CCC(=O)N1CCC2=CC=C(C=C2)C(=O)O)O
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Product OPENEYE NAME: (2R)-2-[[2-[(2,3-difluorophenyl)methylsulfanyl]-7-methyl-pteridin-4-yl]amino]propan-1-ol
CAS Name: (2R)-2-[[2-[(2,3-difluorophenyl)methylthio]-7-methyl-4-pteridinyl]amino]-1-propanol
IUPAC NAME: (2R)-2-[[2-[(2,3-difluorophenyl)methylsulfanyl]-7-methylpteridin-4-yl]amino]propan-1-ol
SYSTEMATIC NAME: (2R)-2-[[2-[[2,3-bis(fluoranyl)phenyl]methylsulfanyl]-7-methyl-pteridin-4-yl]amino]propan-1-ol
MOLECULAR FORMULA: C17H17F2N5OS
MOLECULAR WEIGHT: 377.411586
SMILES: CC1=CN=C2C(=N1)N=C(N=C2N[C@H](C)CO)SCC3=C(C(=CC=C3)F)F
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Product OPENEYE NAME: (2R)-2-[[2-[(2,3-difluorophenyl)methylsulfanyl]-6-methyl-pteridin-4-yl]amino]propan-1-ol
CAS Name: (2R)-2-[[2-[(2,3-difluorophenyl)methylthio]-6-methyl-4-pteridinyl]amino]-1-propanol
IUPAC NAME: (2R)-2-[[2-[(2,3-difluorophenyl)methylsulfanyl]-6-methylpteridin-4-yl]amino]propan-1-ol
SYSTEMATIC NAME: (2R)-2-[[2-[[2,3-bis(fluoranyl)phenyl]methylsulfanyl]-6-methyl-pteridin-4-yl]amino]propan-1-ol
MOLECULAR FORMULA: C17H17F2N5OS
MOLECULAR WEIGHT: 377.411586
SMILES: CC1=CN=C2C(=N1)C(=NC(=N2)SCC3=C(C(=CC=C3)F)F)N[C@H](C)CO
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Product OPENEYE NAME: (1E,4Z,6E)-1,7-bis(4-hydroxy-3-methoxy-phenyl)-5-(isopropylamino)hepta-1,4,6-trien-3-one
CAS Name: (1E,4Z,6E)-1,7-bis(4-hydroxy-3-methoxyphenyl)-5-(propan-2-ylamino)-3-hepta-1,4,6-trienone
IUPAC NAME: (1E,4Z,6E)-1,7-bis(4-hydroxy-3-methoxyphenyl)-5-(propan-2-ylamino)hepta-1,4,6-trien-3-one
SYSTEMATIC NAME: (1E,4Z,6E)-1,7-bis(3-methoxy-4-oxidanyl-phenyl)-5-(propan-2-ylamino)hepta-1,4,6-trien-3-one
MOLECULAR FORMULA: C24H27NO5
MOLECULAR WEIGHT: 409.47488
SMILES: CC(C)N/C(=C\C(=O)/C=C/C1=CC(=C(C=C1)O)OC)/C=C/C2=CC(=C(C=C2)O)OC
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Product OPENEYE NAME: (1E,4Z,6E)-1,7-bis(4-hydroxy-3-methoxy-phenyl)-5-(1-phenylethylamino)hepta-1,4,6-trien-3-one
CAS Name: (1E,4Z,6E)-1,7-bis(4-hydroxy-3-methoxyphenyl)-5-(1-phenylethylamino)-3-hepta-1,4,6-trienone
IUPAC NAME: (1E,4Z,6E)-1,7-bis(4-hydroxy-3-methoxyphenyl)-5-(1-phenylethylamino)hepta-1,4,6-trien-3-one
SYSTEMATIC NAME: (1E,4Z,6E)-1,7-bis(3-methoxy-4-oxidanyl-phenyl)-5-(1-phenylethylamino)hepta-1,4,6-trien-3-one
MOLECULAR FORMULA: C29H29NO5
MOLECULAR WEIGHT: 471.54426
SMILES: CC(C1=CC=CC=C1)N/C(=C\C(=O)/C=C/C2=CC(=C(C=C2)O)OC)/C=C/C3=CC(=C(C=C3)O)OC
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Product OPENEYE NAME: (1E,4Z,6E)-5-amino-1,7-bis(4-hydroxy-3-methoxy-phenyl)hepta-1,4,6-trien-3-one
CAS Name: (1E,4Z,6E)-5-amino-1,7-bis(4-hydroxy-3-methoxyphenyl)-3-hepta-1,4,6-trienone
IUPAC NAME: (1E,4Z,6E)-5-amino-1,7-bis(4-hydroxy-3-methoxyphenyl)hepta-1,4,6-trien-3-one
SYSTEMATIC NAME: (1E,4Z,6E)-5-azanyl-1,7-bis(3-methoxy-4-oxidanyl-phenyl)hepta-1,4,6-trien-3-one
MOLECULAR FORMULA: C21H21NO5
MOLECULAR WEIGHT: 367.39514
SMILES: COC1=C(C=CC(=C1)/C=C/C(=C/C(=O)/C=C/C2=CC(=C(C=C2)O)OC)/N)O
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Product OPENEYE NAME: (1E,4Z,6E)-5-(benzylamino)-1,7-bis(4-hydroxy-3-methoxy-phenyl)hepta-1,4,6-trien-3-one
CAS Name: (1E,4Z,6E)-1,7-bis(4-hydroxy-3-methoxyphenyl)-5-[(phenylmethyl)amino]-3-hepta-1,4,6-trienone
IUPAC NAME: (1E,4Z,6E)-5-(benzylamino)-1,7-bis(4-hydroxy-3-methoxyphenyl)hepta-1,4,6-trien-3-one
SYSTEMATIC NAME: (1E,4Z,6E)-1,7-bis(3-methoxy-4-oxidanyl-phenyl)-5-[(phenylmethyl)amino]hepta-1,4,6-trien-3-one
MOLECULAR FORMULA: C28H27NO5
MOLECULAR WEIGHT: 457.51768
SMILES: COC1=C(C=CC(=C1)/C=C/C(=C/C(=O)/C=C/C2=CC(=C(C=C2)O)OC)/NCC3=CC=CC=C3)O
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Product OPENEYE NAME: [2-(cyclopropylmethyl)-3,4-dihydro-1H-isoquinolin-7-yl] morpholine-4-carboxylate
CAS Name: 4-morpholinecarboxylic acid [2-(cyclopropylmethyl)-3,4-dihydro-1H-isoquinolin-7-yl] ester
IUPAC NAME: [2-(cyclopropylmethyl)-3,4-dihydro-1H-isoquinolin-7-yl] morpholine-4-carboxylate
SYSTEMATIC NAME: [2-(cyclopropylmethyl)-3,4-dihydro-1H-isoquinolin-7-yl] morpholine-4-carboxylate
MOLECULAR FORMULA: C18H24N2O3
MOLECULAR WEIGHT: 316.39476
SMILES: C1CC1CN2CCC3=C(C2)C=C(C=C3)OC(=O)N4CCOCC4
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Product OPENEYE NAME: N-benzyl-N-(1-hydroxy-2-thioxo-3-pyridyl)-4-phenoxy-benzenesulfonamide
CAS Name: N-(1-hydroxy-2-sulfanylidene-3-pyridinyl)-4-phenoxy-N-(phenylmethyl)benzenesulfonamide
IUPAC NAME: N-benzyl-N-(1-hydroxy-2-sulfanylidenepyridin-3-yl)-4-phenoxybenzenesulfonamide
SYSTEMATIC NAME: N-(1-oxidanyl-2-sulfanylidene-pyridin-3-yl)-4-phenoxy-N-(phenylmethyl)benzenesulfonamide
MOLECULAR FORMULA: C24H20N2O4S2
MOLECULAR WEIGHT: 464.5566
SMILES: C1=CC=C(C=C1)CN(C2=CC=CN(C2=S)O)S(=O)(=O)C3=CC=C(C=C3)OC4=CC=CC=C4
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Product OPENEYE NAME: 4-(4-chlorophenoxy)-N-[(3R)-1-hydroxy-2-oxo-3-piperidyl]benzenesulfonamide
CAS Name: 4-(4-chlorophenoxy)-N-[(3R)-1-hydroxy-2-oxo-3-piperidinyl]benzenesulfonamide
IUPAC NAME: 4-(4-chlorophenoxy)-N-[(3R)-1-hydroxy-2-oxopiperidin-3-yl]benzenesulfonamide
SYSTEMATIC NAME: 4-(4-chloranylphenoxy)-N-[(3R)-1-oxidanyl-2-oxidanylidene-piperidin-3-yl]benzenesulfonamide
MOLECULAR FORMULA: C17H17ClN2O5S
MOLECULAR WEIGHT: 396.84528
SMILES: C1C[C@H](C(=O)N(C1)O)NS(=O)(=O)C2=CC=C(C=C2)OC3=CC=C(C=C3)Cl
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Product OPENEYE NAME: 4-[4-[(5S)-5-(acetamidomethyl)-2-oxo-oxazolidin-3-yl]-2-fluoro-phenyl]-N-thiazol-2-yl-piperazine-1-carboxamide
CAS Name: 4-[4-[(5S)-5-(acetamidomethyl)-2-oxo-3-oxazolidinyl]-2-fluorophenyl]-N-(2-thiazolyl)-1-piperazinecarboxamide
IUPAC NAME: 4-[4-[(5S)-5-(acetamidomethyl)-2-oxo-1,3-oxazolidin-3-yl]-2-fluorophenyl]-N-(1,3-thiazol-2-yl)piperazine-1-carboxamide
SYSTEMATIC NAME: 4-[4-[(5S)-5-(acetamidomethyl)-2-oxidanylidene-1,3-oxazolidin-3-yl]-2-fluoranyl-phenyl]-N-(1,3-thiazol-2-yl)piperazine-1-carboxamide
MOLECULAR FORMULA: C20H23FN6O4S
MOLECULAR WEIGHT: 462.497823
SMILES: CC(=O)NC[C@H]1CN(C(=O)O1)C2=CC(=C(C=C2)N3CCN(CC3)C(=O)NC4=NC=CS4)F
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Product OPENEYE NAME: 4-[4-[(5S)-5-(acetamidomethyl)-2-oxo-oxazolidin-3-yl]-2-fluoro-phenyl]-N-(2-pyridyl)piperazine-1-carboxamide
CAS Name: 4-[4-[(5S)-5-(acetamidomethyl)-2-oxo-3-oxazolidinyl]-2-fluorophenyl]-N-(2-pyridinyl)-1-piperazinecarboxamide
IUPAC NAME: 4-[4-[(5S)-5-(acetamidomethyl)-2-oxo-1,3-oxazolidin-3-yl]-2-fluorophenyl]-N-pyridin-2-ylpiperazine-1-carboxamide
SYSTEMATIC NAME: 4-[4-[(5S)-5-(acetamidomethyl)-2-oxidanylidene-1,3-oxazolidin-3-yl]-2-fluoranyl-phenyl]-N-pyridin-2-yl-piperazine-1-carboxamide
MOLECULAR FORMULA: C22H25FN6O4
MOLECULAR WEIGHT: 456.470103
SMILES: CC(=O)NC[C@H]1CN(C(=O)O1)C2=CC(=C(C=C2)N3CCN(CC3)C(=O)NC4=CC=CC=N4)F
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Product OPENEYE NAME: 1-[1-(4-aminophenyl)sulfonyl-3,5-dihydro-2H-4,1-benzoxazepin-3-yl]-5-fluoro-pyrimidine-2,4-dione
CAS Name: 1-[1-(4-aminophenyl)sulfonyl-3,5-dihydro-2H-4,1-benzoxazepin-3-yl]-5-fluoropyrimidine-2,4-dione
IUPAC NAME: 1-[1-(4-aminophenyl)sulfonyl-3,5-dihydro-2H-4,1-benzoxazepin-3-yl]-5-fluoropyrimidine-2,4-dione
SYSTEMATIC NAME: 1-[1-(4-aminophenyl)sulfonyl-3,5-dihydro-2H-4,1-benzoxazepin-3-yl]-5-fluoranyl-pyrimidine-2,4-dione
MOLECULAR FORMULA: C19H17FN4O5S
MOLECULAR WEIGHT: 432.425483
SMILES: C1C(OCC2=CC=CC=C2N1S(=O)(=O)C3=CC=C(C=C3)N)N4C=C(C(=O)NC4=O)F
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Product OPENEYE NAME: 4-[4-[(5S)-5-(acetamidomethyl)-2-oxo-oxazolidin-3-yl]-2-fluoro-phenyl]-N-isoxazol-3-yl-piperazine-1-carboxamide
CAS Name: 4-[4-[(5S)-5-(acetamidomethyl)-2-oxo-3-oxazolidinyl]-2-fluorophenyl]-N-(3-isoxazolyl)-1-piperazinecarboxamide
IUPAC NAME: 4-[4-[(5S)-5-(acetamidomethyl)-2-oxo-1,3-oxazolidin-3-yl]-2-fluorophenyl]-N-(1,2-oxazol-3-yl)piperazine-1-carboxamide
SYSTEMATIC NAME: 4-[4-[(5S)-5-(acetamidomethyl)-2-oxidanylidene-1,3-oxazolidin-3-yl]-2-fluoranyl-phenyl]-N-(1,2-oxazol-3-yl)piperazine-1-carboxamide
MOLECULAR FORMULA: C20H23FN6O5
MOLECULAR WEIGHT: 446.432223
SMILES: CC(=O)NC[C@H]1CN(C(=O)O1)C2=CC(=C(C=C2)N3CCN(CC3)C(=O)NC4=NOC=C4)F
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Product OPENEYE NAME: 5-fluoro-1-(1,2,3,5-tetrahydro-4,1-benzoxazepin-3-yl)pyrimidine-2,4-dione
CAS Name: 5-fluoro-1-(1,2,3,5-tetrahydro-4,1-benzoxazepin-3-yl)pyrimidine-2,4-dione
IUPAC NAME: 5-fluoro-1-(1,2,3,5-tetrahydro-4,1-benzoxazepin-3-yl)pyrimidine-2,4-dione
SYSTEMATIC NAME: 5-fluoranyl-1-(1,2,3,5-tetrahydro-4,1-benzoxazepin-3-yl)pyrimidine-2,4-dione
MOLECULAR FORMULA: C13H12FN3O3
MOLECULAR WEIGHT: 277.251083
SMILES: C1C(OCC2=CC=CC=C2N1)N3C=C(C(=O)NC3=O)F
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Product OPENEYE NAME: 2-[1-(3,5-dichlorophenyl)sulfonylpyrrolidin-2-yl]-5-(2-naphthylmethyl)-1H-imidazole-4-carboxylic acid
CAS Name: 2-[1-(3,5-dichlorophenyl)sulfonyl-2-pyrrolidinyl]-5-(2-naphthalenylmethyl)-1H-imidazole-4-carboxylic acid
IUPAC NAME: 2-[1-(3,5-dichlorophenyl)sulfonylpyrrolidin-2-yl]-5-(naphthalen-2-ylmethyl)-1H-imidazole-4-carboxylic acid
SYSTEMATIC NAME: 2-[1-[3,5-bis(chloranyl)phenyl]sulfonylpyrrolidin-2-yl]-5-(naphthalen-2-ylmethyl)-1H-imidazole-4-carboxylic acid
MOLECULAR FORMULA: C25H21Cl2N3O4S
MOLECULAR WEIGHT: 530.42294
SMILES: C1CC(N(C1)S(=O)(=O)C2=CC(=CC(=C2)Cl)Cl)C3=NC(=C(N3)CC4=CC5=CC=CC=C5C=C4)C(=O)O
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Product OPENEYE NAME: sodium 5-[(2-benzyloxy-5-chloro-phenyl)methyl]thiophene-3-carboxylate
CAS Name: sodium 5-[(5-chloro-2-phenylmethoxyphenyl)methyl]-3-thiophenecarboxylate
IUPAC NAME: sodium 5-[(5-chloro-2-phenylmethoxyphenyl)methyl]thiophene-3-carboxylate
SYSTEMATIC NAME: sodium 5-[(5-chloranyl-2-phenylmethoxy-phenyl)methyl]thiophene-3-carboxylate
MOLECULAR FORMULA: C19H14ClNaO3S
MOLECULAR WEIGHT: 380.82043
SMILES: C1=CC=C(C=C1)COC2=C(C=C(C=C2)Cl)CC3=CC(=CS3)C(=O)[O-].[Na+]
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Product OPENEYE NAME: 5-[(2-benzyloxy-5-chloro-phenyl)methyl]thiophene-3-carboxylic acid
CAS Name: 5-[(5-chloro-2-phenylmethoxyphenyl)methyl]-3-thiophenecarboxylic acid
IUPAC NAME: 5-[(5-chloro-2-phenylmethoxyphenyl)methyl]thiophene-3-carboxylic acid
SYSTEMATIC NAME: 5-[(5-chloranyl-2-phenylmethoxy-phenyl)methyl]thiophene-3-carboxylic acid
MOLECULAR FORMULA: C19H15ClO3S
MOLECULAR WEIGHT: 358.8386
SMILES: C1=CC=C(C=C1)COC2=C(C=C(C=C2)Cl)CC3=CC(=CS3)C(=O)O
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