Product OPENEYE NAME: 6-chloro-N-[1-[4-[5-[(dimethylamino)methyl]pyrazol-1-yl]-2-fluoro-phenyl]-2-oxo-pyrrolidin-3-yl]benzothiophene-2-sulfonamide
CAS Name: 6-chloro-N-[1-[4-[5-[(dimethylamino)methyl]-1-pyrazolyl]-2-fluorophenyl]-2-oxo-3-pyrrolidinyl]-1-benzothiophene-2-sulfonamide
IUPAC NAME: 6-chloro-N-[1-[4-[5-[(dimethylamino)methyl]pyrazol-1-yl]-2-fluorophenyl]-2-oxopyrrolidin-3-yl]-1-benzothiophene-2-sulfonamide
SYSTEMATIC NAME: 6-chloranyl-N-[1-[4-[5-[(dimethylamino)methyl]pyrazol-1-yl]-2-fluoranyl-phenyl]-2-oxidanylidene-pyrrolidin-3-yl]-1-benzothiophene-2-sulfonamide
MOLECULAR FORMULA: C24H23ClFN5O3S2
MOLECULAR WEIGHT: 548.052523
SMILES: CN(C)CC1=CC=NN1C2=CC(=C(C=C2)N3CCC(C3=O)NS(=O)(=O)C4=CC5=C(S4)C=C(C=C5)Cl)F
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Product OPENEYE NAME: (E)-2-(5-chloro-2-thienyl)-N-[1-[4-[3-[(dimethylamino)methyl]isoxazol-4-yl]-2-fluoro-phenyl]-2-oxo-pyrrolidin-3-yl]ethenesulfonamide
CAS Name: (E)-2-(5-chloro-2-thiophenyl)-N-[1-[4-[3-[(dimethylamino)methyl]-4-isoxazolyl]-2-fluorophenyl]-2-oxo-3-pyrrolidinyl]ethenesulfonamide
IUPAC NAME: (E)-2-(5-chlorothiophen-2-yl)-N-[1-[4-[3-[(dimethylamino)methyl]-1,2-oxazol-4-yl]-2-fluorophenyl]-2-oxopyrrolidin-3-yl]ethenesulfonamide
SYSTEMATIC NAME: (E)-2-(5-chloranylthiophen-2-yl)-N-[1-[4-[3-[(dimethylamino)methyl]-1,2-oxazol-4-yl]-2-fluoranyl-phenyl]-2-oxidanylidene-pyrrolidin-3-yl]ethenesulfonamide
MOLECULAR FORMULA: C22H22ClFN4O4S2
MOLECULAR WEIGHT: 525.015883
SMILES: CN(C)CC1=NOC=C1C2=CC(=C(C=C2)N3CCC(C3=O)NS(=O)(=O)/C=C/C4=CC=C(S4)Cl)F
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Product OPENEYE NAME: 5-(3-chlorophenyl)-2,3-diphenyl-tetrazol-2-ium chloride
CAS Name: 5-(3-chlorophenyl)-2,3-diphenyltetrazol-2-ium chloride
IUPAC NAME: 5-(3-chlorophenyl)-2,3-diphenyltetrazol-2-ium chloride
SYSTEMATIC NAME: 5-(3-chlorophenyl)-2,3-diphenyl-1,2,3,4-tetrazol-2-ium chloride
MOLECULAR FORMULA: C19H14Cl2N4
MOLECULAR WEIGHT: 369.24726
SMILES: C1=CC=C(C=C1)N2N=C(N=[N+]2C3=CC=CC=C3)C4=CC(=CC=C4)Cl.[Cl-]
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Product OPENEYE NAME: 5-(3-chlorophenyl)-2,3-diphenyl-tetrazol-2-ium
CAS Name: 5-(3-chlorophenyl)-2,3-diphenyltetrazol-2-ium
IUPAC NAME: 5-(3-chlorophenyl)-2,3-diphenyltetrazol-2-ium
SYSTEMATIC NAME: 5-(3-chlorophenyl)-2,3-diphenyl-1,2,3,4-tetrazol-2-ium
MOLECULAR FORMULA: C19H14ClN4+
MOLECULAR WEIGHT: 333.79426
SMILES: C1=CC=C(C=C1)N2N=C(N=[N+]2C3=CC=CC=C3)C4=CC(=CC=C4)Cl
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Product OPENEYE NAME: tripotassium (2S)-2-[[[(3S,5S,8R,9S,10S,13S,14S)-10,13-dimethyl-17-oxo-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-3-yl]oxy-oxido-phosphoryl]amino]pentanedioate
CAS Name: tripotassium (2S)-2-[[[(3S,5S,8R,9S,10S,13S,14S)-10,13-dimethyl-17-oxo-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-3-yl]oxy-oxidophosphoryl]amino]pentanedioate
IUPAC NAME: tripotassium (2S)-2-[[[(3S,5S,8R,9S,10S,13S,14S)-10,13-dimethyl-17-oxo-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-3-yl]oxy-oxidophosphoryl]amino]pentanedioate
SYSTEMATIC NAME: tripotassium (2S)-2-[[[(3S,5S,8R,9S,10S,13S,14S)-10,13-dimethyl-17-oxidanylidene-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-3-yl]oxy-oxidanidyl-phosphoryl]amino]pentanedioate
MOLECULAR FORMULA: C24H35K3NO8P
MOLECULAR WEIGHT: 613.805261
SMILES: C[C@]12CC[C@@H](C[C@@H]1CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CCC4=O)C)OP(=O)(N[C@@H](CCC(=O)[O-])C(=O)[O-])[O-].[K+].[K+].[K+]
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Product OPENEYE NAME: (2S)-2-[[[(3S,5S,8R,9S,10S,13S,14S)-10,13-dimethyl-17-oxo-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-3-yl]oxy-hydroxy-phosphoryl]amino]pentanedioic acid
CAS Name: (2S)-2-[[[(3S,5S,8R,9S,10S,13S,14S)-10,13-dimethyl-17-oxo-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-3-yl]oxy-hydroxyphosphoryl]amino]pentanedioic acid
IUPAC NAME: (2S)-2-[[[(3S,5S,8R,9S,10S,13S,14S)-10,13-dimethyl-17-oxo-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-3-yl]oxy-hydroxyphosphoryl]amino]pentanedioic acid
SYSTEMATIC NAME: (2S)-2-[[[(3S,5S,8R,9S,10S,13S,14S)-10,13-dimethyl-17-oxidanylidene-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-3-yl]oxy-oxidanyl-phosphoryl]amino]pentanedioic acid
MOLECULAR FORMULA: C24H38NO8P
MOLECULAR WEIGHT: 499.534181
SMILES: C[C@]12CC[C@@H](C[C@@H]1CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CCC4=O)C)OP(=O)(N[C@@H](CCC(=O)O)C(=O)O)O
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Product OPENEYE NAME: 5-(4-benzyloxyphenyl)-2-(4-nitrophenyl)-3-phenyl-tetrazol-2-ium chloride
CAS Name: 2-(4-nitrophenyl)-3-phenyl-5-(4-phenylmethoxyphenyl)tetrazol-2-ium chloride
IUPAC NAME: 2-(4-nitrophenyl)-3-phenyl-5-(4-phenylmethoxyphenyl)tetrazol-2-ium chloride
SYSTEMATIC NAME: 2-(4-nitrophenyl)-3-phenyl-5-(4-phenylmethoxyphenyl)-1,2,3,4-tetrazol-2-ium chloride
MOLECULAR FORMULA: C26H20ClN5O3
MOLECULAR WEIGHT: 485.9217
SMILES: C1=CC=C(C=C1)COC2=CC=C(C=C2)C3=NN([N+](=N3)C4=CC=C(C=C4)[N+](=O)[O-])C5=CC=CC=C5.[Cl-]
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Product OPENEYE NAME: 5-(4-benzyloxyphenyl)-2-(4-nitrophenyl)-3-phenyl-tetrazol-2-ium
CAS Name: 2-(4-nitrophenyl)-3-phenyl-5-(4-phenylmethoxyphenyl)tetrazol-2-ium
IUPAC NAME: 2-(4-nitrophenyl)-3-phenyl-5-(4-phenylmethoxyphenyl)tetrazol-2-ium
SYSTEMATIC NAME: 2-(4-nitrophenyl)-3-phenyl-5-(4-phenylmethoxyphenyl)-1,2,3,4-tetrazol-2-ium
MOLECULAR FORMULA: C26H20N5O3+
MOLECULAR WEIGHT: 450.4687
SMILES: C1=CC=C(C=C1)COC2=CC=C(C=C2)C3=NN([N+](=N3)C4=CC=C(C=C4)[N+](=O)[O-])C5=CC=CC=C5
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Product OPENEYE NAME: [2,6-dimethoxy-4-[2-(4-nitrophenyl)-3-phenyl-tetrazol-2-ium-5-yl]phenyl] acetate chloride
CAS Name: acetic acid [2,6-dimethoxy-4-[2-(4-nitrophenyl)-3-phenyl-5-tetrazol-2-iumyl]phenyl] ester chloride
IUPAC NAME: [2,6-dimethoxy-4-[2-(4-nitrophenyl)-3-phenyltetrazol-2-ium-5-yl]phenyl] acetate chloride
SYSTEMATIC NAME: [2,6-dimethoxy-4-[2-(4-nitrophenyl)-3-phenyl-1,2,3,4-tetrazol-2-ium-5-yl]phenyl] ethanoate chloride
MOLECULAR FORMULA: C23H20ClN5O6
MOLECULAR WEIGHT: 497.8878
SMILES: CC(=O)OC1=C(C=C(C=C1OC)C2=NN([N+](=N2)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4)OC.[Cl-]
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Product OPENEYE NAME: [2,6-dimethoxy-4-[2-(4-nitrophenyl)-3-phenyl-tetrazol-2-ium-5-yl]phenyl] acetate
CAS Name: acetic acid [2,6-dimethoxy-4-[2-(4-nitrophenyl)-3-phenyl-5-tetrazol-2-iumyl]phenyl] ester
IUPAC NAME: [2,6-dimethoxy-4-[2-(4-nitrophenyl)-3-phenyltetrazol-2-ium-5-yl]phenyl] acetate
SYSTEMATIC NAME: [2,6-dimethoxy-4-[2-(4-nitrophenyl)-3-phenyl-1,2,3,4-tetrazol-2-ium-5-yl]phenyl] ethanoate
MOLECULAR FORMULA: C23H20N5O6+
MOLECULAR WEIGHT: 462.4348
SMILES: CC(=O)OC1=C(C=C(C=C1OC)C2=NN([N+](=N2)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4)OC
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Product OPENEYE NAME: (2S)-1-[2-(4-benzyloxyphenyl)ethyl]-2-methyl-pyrrolidine
CAS Name: (2S)-2-methyl-1-[2-(4-phenylmethoxyphenyl)ethyl]pyrrolidine
IUPAC NAME: (2S)-2-methyl-1-[2-(4-phenylmethoxyphenyl)ethyl]pyrrolidine
SYSTEMATIC NAME: (2S)-2-methyl-1-[2-(4-phenylmethoxyphenyl)ethyl]pyrrolidine
MOLECULAR FORMULA: C20H25NO
MOLECULAR WEIGHT: 295.4186
SMILES: C[C@H]1CCCN1CCC2=CC=C(C=C2)OCC3=CC=CC=C3
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Product OPENEYE NAME: 5-[2-(2,6-dichlorophenyl)-4-(2,4-difluorophenyl)-1H-imidazol-5-yl]-3-isobutyl-imidazo[4,5-b]pyridine; methanesulfonic acid
CAS Name: 5-[2-(2,6-dichlorophenyl)-4-(2,4-difluorophenyl)-1H-imidazol-5-yl]-3-(2-methylpropyl)imidazo[4,5-b]pyridine; methanesulfonic acid
IUPAC NAME: 5-[2-(2,6-dichlorophenyl)-4-(2,4-difluorophenyl)-1H-imidazol-5-yl]-3-(2-methylpropyl)imidazo[4,5-b]pyridine; methanesulfonic acid
SYSTEMATIC NAME: 5-[2-[2,6-bis(chloranyl)phenyl]-4-[2,4-bis(fluoranyl)phenyl]-1H-imidazol-5-yl]-3-(2-methylpropyl)imidazo[4,5-b]pyridine; methanesulfonic acid
MOLECULAR FORMULA: C26H23Cl2F2N5O3S
MOLECULAR WEIGHT: 594.460326
SMILES: CC(C)CN1C=NC2=C1N=C(C=C2)C3=C(N=C(N3)C4=C(C=CC=C4Cl)Cl)C5=C(C=C(C=C5)F)F.CS(=O)(=O)O
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Product OPENEYE NAME: 5-[2-(2,6-dichlorophenyl)-4-(2,4-difluorophenyl)-1H-imidazol-5-yl]-3-isobutyl-imidazo[4,5-b]pyridine
CAS Name: 5-[2-(2,6-dichlorophenyl)-4-(2,4-difluorophenyl)-1H-imidazol-5-yl]-3-(2-methylpropyl)imidazo[4,5-b]pyridine
IUPAC NAME: 5-[2-(2,6-dichlorophenyl)-4-(2,4-difluorophenyl)-1H-imidazol-5-yl]-3-(2-methylpropyl)imidazo[4,5-b]pyridine
SYSTEMATIC NAME: 5-[2-[2,6-bis(chloranyl)phenyl]-4-[2,4-bis(fluoranyl)phenyl]-1H-imidazol-5-yl]-3-(2-methylpropyl)imidazo[4,5-b]pyridine
MOLECULAR FORMULA: C25H19Cl2F2N5
MOLECULAR WEIGHT: 498.354666
SMILES: CC(C)CN1C=NC2=C1N=C(C=C2)C3=C(N=C(N3)C4=C(C=CC=C4Cl)Cl)C5=C(C=C(C=C5)F)F
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Product OPENEYE NAME: 1-[2-(4-benzyloxyphenyl)ethyl]pyrrolidine
CAS Name: 1-[2-(4-phenylmethoxyphenyl)ethyl]pyrrolidine
IUPAC NAME: 1-[2-(4-phenylmethoxyphenyl)ethyl]pyrrolidine
SYSTEMATIC NAME: 1-[2-(4-phenylmethoxyphenyl)ethyl]pyrrolidine
MOLECULAR FORMULA: C19H23NO
MOLECULAR WEIGHT: 281.39202
SMILES: C1CCN(C1)CCC2=CC=C(C=C2)OCC3=CC=CC=C3
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Product OPENEYE NAME: (2R)-2-methyl-1-[2-(2-naphthyl)ethyl]pyrrolidine
CAS Name: (2R)-2-methyl-1-[2-(2-naphthalenyl)ethyl]pyrrolidine
IUPAC NAME: (2R)-2-methyl-1-(2-naphthalen-2-ylethyl)pyrrolidine
SYSTEMATIC NAME: (2R)-2-methyl-1-(2-naphthalen-2-ylethyl)pyrrolidine
MOLECULAR FORMULA: C17H21N
MOLECULAR WEIGHT: 239.35534
SMILES: C[C@@H]1CCCN1CCC2=CC3=CC=CC=C3C=C2
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Product OPENEYE NAME: 3-[2-[(2S)-2-methylpyrrolidin-1-yl]ethyl]pyridine
CAS Name: 3-[2-[(2S)-2-methyl-1-pyrrolidinyl]ethyl]pyridine
IUPAC NAME: 3-[2-[(2S)-2-methylpyrrolidin-1-yl]ethyl]pyridine
SYSTEMATIC NAME: 3-[2-[(2S)-2-methylpyrrolidin-1-yl]ethyl]pyridine
MOLECULAR FORMULA: C12H18N2
MOLECULAR WEIGHT: 190.28472
SMILES: C[C@H]1CCCN1CCC2=CN=CC=C2
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Product OPENEYE NAME: 3-[2-[(2R)-2-methylpyrrolidin-1-yl]ethyl]pyridine
CAS Name: 3-[2-[(2R)-2-methyl-1-pyrrolidinyl]ethyl]pyridine
IUPAC NAME: 3-[2-[(2R)-2-methylpyrrolidin-1-yl]ethyl]pyridine
SYSTEMATIC NAME: 3-[2-[(2R)-2-methylpyrrolidin-1-yl]ethyl]pyridine
MOLECULAR FORMULA: C12H18N2
MOLECULAR WEIGHT: 190.28472
SMILES: C[C@@H]1CCCN1CCC2=CN=CC=C2
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Product OPENEYE NAME: [(3S)-3-(hexadecanoylamino)-2-hydroxy-5-methyl-hexyl]phosphonic acid
CAS Name: [(3S)-2-hydroxy-5-methyl-3-(1-oxohexadecylamino)hexyl]phosphonic acid
IUPAC NAME: [(3S)-3-(hexadecanoylamino)-2-hydroxy-5-methylhexyl]phosphonic acid
SYSTEMATIC NAME: [(3S)-3-(hexadecanoylamino)-5-methyl-2-oxidanyl-hexyl]phosphonic acid
MOLECULAR FORMULA: C23H48NO5P
MOLECULAR WEIGHT: 449.604681
SMILES: CCCCCCCCCCCCCCCC(=O)N[C@@H](CC(C)C)C(CP(=O)(O)O)O
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Product OPENEYE NAME: N-[(1S)-1-[2-[4-[(3S,4R)-4-(2,4-dichlorophenyl)-1-isopropyl-pyrrolidine-3-carbonyl]piperazin-1-yl]-3-fluoro-phenyl]-2-methyl-propyl]-3-(dimethylamino)propanamide
CAS Name: N-[(1S)-1-[2-[4-[[(3S,4R)-4-(2,4-dichlorophenyl)-1-propan-2-yl-3-pyrrolidinyl]-oxomethyl]-1-piperazinyl]-3-fluorophenyl]-2-methylpropyl]-3-(dimethylamino)propanamide
IUPAC NAME: N-[(1S)-1-[2-[4-[(3S,4R)-4-(2,4-dichlorophenyl)-1-propan-2-ylpyrrolidine-3-carbonyl]piperazin-1-yl]-3-fluorophenyl]-2-methylpropyl]-3-(dimethylamino)propanamide
SYSTEMATIC NAME: N-[(1S)-1-[2-[4-[(3S,4R)-4-(2,4-dichlorophenyl)-1-propan-2-yl-pyrrolidin-3-yl]carbonylpiperazin-1-yl]-3-fluoranyl-phenyl]-2-methyl-propyl]-3-(dimethylamino)propanamide
MOLECULAR FORMULA: C33H46Cl2FN5O2
MOLECULAR WEIGHT: 634.655043
SMILES: CC(C)[C@@H](C1=C(C(=CC=C1)F)N2CCN(CC2)C(=O)[C@@H]3CN(C[C@H]3C4=C(C=C(C=C4)Cl)Cl)C(C)C)NC(=O)CCN(C)C
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Product OPENEYE NAME: N-[(1S)-1-[2-[4-[(3S,4R)-4-(2,5-difluorophenyl)-1-isopropyl-pyrrolidine-3-carbonyl]piperazin-1-yl]-3-fluoro-phenyl]-2-methyl-propyl]-3-(dimethylamino)propanamide
CAS Name: N-[(1S)-1-[2-[4-[[(3S,4R)-4-(2,5-difluorophenyl)-1-propan-2-yl-3-pyrrolidinyl]-oxomethyl]-1-piperazinyl]-3-fluorophenyl]-2-methylpropyl]-3-(dimethylamino)propanamide
IUPAC NAME: N-[(1S)-1-[2-[4-[(3S,4R)-4-(2,5-difluorophenyl)-1-propan-2-ylpyrrolidine-3-carbonyl]piperazin-1-yl]-3-fluorophenyl]-2-methylpropyl]-3-(dimethylamino)propanamide
SYSTEMATIC NAME: N-[(1S)-1-[2-[4-[(3S,4R)-4-[2,5-bis(fluoranyl)phenyl]-1-propan-2-yl-pyrrolidin-3-yl]carbonylpiperazin-1-yl]-3-fluoranyl-phenyl]-2-methyl-propyl]-3-(dimethylamino)propanamide
MOLECULAR FORMULA: C33H46F3N5O2
MOLECULAR WEIGHT: 601.74585
SMILES: CC(C)[C@@H](C1=C(C(=CC=C1)F)N2CCN(CC2)C(=O)[C@@H]3CN(C[C@H]3C4=C(C=CC(=C4)F)F)C(C)C)NC(=O)CCN(C)C
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