Product OPENEYE NAME: 4,4,4-trifluoro-2-hydroxy-3,3-dimethyl-N-(4-nitrophenyl)butanamide
CAS Name: 4,4,4-trifluoro-2-hydroxy-3,3-dimethyl-N-(4-nitrophenyl)butanamide
IUPAC NAME: 4,4,4-trifluoro-2-hydroxy-3,3-dimethyl-N-(4-nitrophenyl)butanamide
SYSTEMATIC NAME: 4,4,4-tris(fluoranyl)-3,3-dimethyl-N-(4-nitrophenyl)-2-oxidanyl-butanamide
MOLECULAR FORMULA: C12H13F3N2O4
MOLECULAR WEIGHT: 306.23783
SMILES: CC(C)(C(C(=O)NC1=CC=C(C=C1)[N+](=O)[O-])O)C(F)(F)F
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Product OPENEYE NAME: 2-chloro-4,4,4-trifluoro-3-iodo-3-(nitromethyl)-N-phenyl-butanamide
CAS Name: 2-chloro-4,4,4-trifluoro-3-iodo-3-(nitromethyl)-N-phenylbutanamide
IUPAC NAME: 2-chloro-4,4,4-trifluoro-3-iodo-3-(nitromethyl)-N-phenylbutanamide
SYSTEMATIC NAME: 2-chloranyl-4,4,4-tris(fluoranyl)-3-iodanyl-3-(nitromethyl)-N-phenyl-butanamide
MOLECULAR FORMULA: C11H9ClF3IN2O3
MOLECULAR WEIGHT: 436.55344
SMILES: C1=CC=C(C=C1)NC(=O)C(C(C[N+](=O)[O-])(C(F)(F)F)I)Cl
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Product OPENEYE NAME: 1-[2-[2-chloro-4-hydroxy-3-(trifluoromethyl)cyclobutyl]phenyl]-3-phenyl-urea
CAS Name: 1-[2-[2-chloro-4-hydroxy-3-(trifluoromethyl)cyclobutyl]phenyl]-3-phenylurea
IUPAC NAME: 1-[2-[2-chloro-4-hydroxy-3-(trifluoromethyl)cyclobutyl]phenyl]-3-phenylurea
SYSTEMATIC NAME: 1-[2-[2-chloranyl-4-oxidanyl-3-(trifluoromethyl)cyclobutyl]phenyl]-3-phenyl-urea
MOLECULAR FORMULA: C18H16ClF3N2O2
MOLECULAR WEIGHT: 384.78005
SMILES: C1=CC=C(C=C1)NC(=O)NC2=CC=CC=C2C3C(C(C3Cl)C(F)(F)F)O
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Product OPENEYE NAME: 4,4,4-trifluoro-2-hydroxy-2-methyl-3-(nitromethyl)-N-phenyl-butanamide
CAS Name: 4,4,4-trifluoro-2-hydroxy-2-methyl-3-(nitromethyl)-N-phenylbutanamide
IUPAC NAME: 4,4,4-trifluoro-2-hydroxy-2-methyl-3-(nitromethyl)-N-phenylbutanamide
SYSTEMATIC NAME: 4,4,4-tris(fluoranyl)-2-methyl-3-(nitromethyl)-2-oxidanyl-N-phenyl-butanamide
MOLECULAR FORMULA: C12H13F3N2O4
MOLECULAR WEIGHT: 306.23783
SMILES: CC(C(C[N+](=O)[O-])C(F)(F)F)(C(=O)NC1=CC=CC=C1)O
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Product OPENEYE NAME: 1-(2-bromo-6-cyclopropyl-4-nitro-phenyl)-3-phenyl-urea
CAS Name: 1-(2-bromo-6-cyclopropyl-4-nitrophenyl)-3-phenylurea
IUPAC NAME: 1-(2-bromo-6-cyclopropyl-4-nitrophenyl)-3-phenylurea
SYSTEMATIC NAME: 1-(2-bromanyl-6-cyclopropyl-4-nitro-phenyl)-3-phenyl-urea
MOLECULAR FORMULA: C16H14BrN3O3
MOLECULAR WEIGHT: 376.20466
SMILES: C1CC1C2=CC(=CC(=C2NC(=O)NC3=CC=CC=C3)Br)[N+](=O)[O-]
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Product OPENEYE NAME: 2-hydroxy-4-nitro-N-phenyl-butanamide
CAS Name: 2-hydroxy-4-nitro-N-phenylbutanamide
IUPAC NAME: 2-hydroxy-4-nitro-N-phenylbutanamide
SYSTEMATIC NAME: 4-nitro-2-oxidanyl-N-phenyl-butanamide
MOLECULAR FORMULA: C10H12N2O4
MOLECULAR WEIGHT: 224.21328
SMILES: C1=CC=C(C=C1)NC(=O)C(CC[N+](=O)[O-])O
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Product OPENEYE NAME: 2-ethyl-4,4,4-trifluoro-2-hydroxy-3-(nitromethyl)-N-phenyl-butanamide
CAS Name: 2-ethyl-4,4,4-trifluoro-2-hydroxy-3-(nitromethyl)-N-phenylbutanamide
IUPAC NAME: 2-ethyl-4,4,4-trifluoro-2-hydroxy-3-(nitromethyl)-N-phenylbutanamide
SYSTEMATIC NAME: 2-ethyl-4,4,4-tris(fluoranyl)-3-(nitromethyl)-2-oxidanyl-N-phenyl-butanamide
MOLECULAR FORMULA: C13H15F3N2O4
MOLECULAR WEIGHT: 320.26441
SMILES: CCC(C(C[N+](=O)[O-])C(F)(F)F)(C(=O)NC1=CC=CC=C1)O
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Product OPENEYE NAME: 3-bromo-2-hydroxy-3-methyl-4-nitro-N-phenyl-pentanamide
CAS Name: 3-bromo-2-hydroxy-3-methyl-4-nitro-N-phenylpentanamide
IUPAC NAME: 3-bromo-2-hydroxy-3-methyl-4-nitro-N-phenylpentanamide
SYSTEMATIC NAME: 3-bromanyl-3-methyl-4-nitro-2-oxidanyl-N-phenyl-pentanamide
MOLECULAR FORMULA: C12H15BrN2O4
MOLECULAR WEIGHT: 331.1625
SMILES: CC(C(C)(C(C(=O)NC1=CC=CC=C1)O)Br)[N+](=O)[O-]
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Product OPENEYE NAME: 1-[2-hydroxy-4-iodo-6-[2-(trifluoromethyl)cyclopropyl]phenyl]-3-phenyl-urea
CAS Name: 1-[2-hydroxy-4-iodo-6-[2-(trifluoromethyl)cyclopropyl]phenyl]-3-phenylurea
IUPAC NAME: 1-[2-hydroxy-4-iodo-6-[2-(trifluoromethyl)cyclopropyl]phenyl]-3-phenylurea
SYSTEMATIC NAME: 1-[4-iodanyl-2-oxidanyl-6-[2-(trifluoromethyl)cyclopropyl]phenyl]-3-phenyl-urea
MOLECULAR FORMULA: C17H14F3IN2O2
MOLECULAR WEIGHT: 462.20494
SMILES: C1C(C1C(F)(F)F)C2=CC(=CC(=C2NC(=O)NC3=CC=CC=C3)O)I
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Product OPENEYE NAME: 1-[5-bromo-2-cyclopropyl-6-hydroxy-5,6-dimethyl-4-(trifluoromethyl)cyclohexa-1,3-dien-1-yl]-3-phenyl-urea
CAS Name: 1-[5-bromo-2-cyclopropyl-6-hydroxy-5,6-dimethyl-4-(trifluoromethyl)-1-cyclohexa-1,3-dienyl]-3-phenylurea
IUPAC NAME: 1-[5-bromo-2-cyclopropyl-6-hydroxy-5,6-dimethyl-4-(trifluoromethyl)cyclohexa-1,3-dien-1-yl]-3-phenylurea
SYSTEMATIC NAME: 1-[5-bromanyl-2-cyclopropyl-5,6-dimethyl-6-oxidanyl-4-(trifluoromethyl)cyclohexa-1,3-dien-1-yl]-3-phenyl-urea
MOLECULAR FORMULA: C19H20BrF3N2O2
MOLECULAR WEIGHT: 445.27351
SMILES: CC1(C(=CC(=C(C1(C)O)NC(=O)NC2=CC=CC=C2)C3CC3)C(F)(F)F)Br
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Product OPENEYE NAME: 4-amino-5-[[2-(carboxylatomethylamino)-2-oxo-1-(sulfanylmethyl)ethyl]amino]-5-oxo-pentanoate; gold(3+)
CAS Name: 4-amino-5-[[1-(carboxylatomethylamino)-3-mercapto-1-oxopropan-2-yl]amino]-5-oxopentanoate; gold(3+)
IUPAC NAME: 4-amino-5-[[1-(carboxylatomethylamino)-1-oxo-3-sulfanylpropan-2-yl]amino]-5-oxopentanoate; gold(3+)
SYSTEMATIC NAME: 4-azanyl-5-[[1-[(2-oxidanidyl-2-oxidanylidene-ethyl)amino]-1-oxidanylidene-3-sulfanyl-propan-2-yl]amino]-5-oxidanylidene-pentanoate; gold(3+)
MOLECULAR FORMULA: C30H45Au2N9O18S3
MOLECULAR WEIGHT: 1309.8559
SMILES: C(CC(=O)[O-])C(C(=O)NC(CS)C(=O)NCC(=O)[O-])N.C(CC(=O)[O-])C(C(=O)NC(CS)C(=O)NCC(=O)[O-])N.C(CC(=O)[O-])C(C(=O)NC(CS)C(=O)NCC(=O)[O-])N.[Au+3].[Au+3]
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Product OPENEYE NAME: tetrahydrofuran acetate
CAS Name: oxolane acetate
IUPAC NAME: oxolane acetate
SYSTEMATIC NAME: oxolane ethanoate
MOLECULAR FORMULA: C6H11O3-
MOLECULAR WEIGHT: 131.14974
SMILES: CC(=O)[O-].C1CCOC1
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Product OPENEYE NAME: [1-[4-[(1E)-2,6-dimethylhepta-1,5-dienyl]phenyl]-1-phosphono-butyl]-(ethoxymethyl)-oxo-phosphonium
CAS Name: [1-[4-[(1E)-2,6-dimethylhepta-1,5-dienyl]phenyl]-1-phosphonobutyl]-(ethoxymethyl)-oxophosphonium
IUPAC NAME: [1-[4-[(1E)-2,6-dimethylhepta-1,5-dienyl]phenyl]-1-phosphonobutyl]-(ethoxymethyl)-oxophosphanium
SYSTEMATIC NAME: [1-[4-[(1E)-2,6-dimethylhepta-1,5-dienyl]phenyl]-1-phosphono-butyl]-(ethoxymethyl)-oxidanylidene-phosphanium
MOLECULAR FORMULA: C22H35O5P2+
MOLECULAR WEIGHT: 441.457822
SMILES: CCCC(C1=CC=C(C=C1)/C=C(\C)/CCC=C(C)C)([P+](=O)COCC)P(=O)(O)O
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Product OPENEYE NAME: [1-[4-[(1E)-2,6-dimethylhepta-1,5-dienyl]phenyl]-1-phosphono-butyl]-(hydroxymethyl)-oxo-phosphonium
CAS Name: [1-[4-[(1E)-2,6-dimethylhepta-1,5-dienyl]phenyl]-1-phosphonobutyl]-(hydroxymethyl)-oxophosphonium
IUPAC NAME: [1-[4-[(1E)-2,6-dimethylhepta-1,5-dienyl]phenyl]-1-phosphonobutyl]-(hydroxymethyl)-oxophosphanium
SYSTEMATIC NAME: [1-[4-[(1E)-2,6-dimethylhepta-1,5-dienyl]phenyl]-1-phosphono-butyl]-(hydroxymethyl)-oxidanylidene-phosphanium
MOLECULAR FORMULA: C20H31O5P2+
MOLECULAR WEIGHT: 413.404662
SMILES: CCCC(C1=CC=C(C=C1)/C=C(\C)/CCC=C(C)C)([P+](=O)CO)P(=O)(O)O
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Product OPENEYE NAME: 4-(1H-indol-3-ylmethyl)-1-methyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine
CAS Name: 4-(1H-indol-3-ylmethyl)-1-methyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine
IUPAC NAME: 4-(1H-indol-3-ylmethyl)-1-methyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine
SYSTEMATIC NAME: 4-(1H-indol-3-ylmethyl)-1-methyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine
MOLECULAR FORMULA: C20H17N5
MOLECULAR WEIGHT: 327.38248
SMILES: CC1=NN=C2N1C3=CC=CC=C3C=NC2CC4=CNC5=CC=CC=C54
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Product OPENEYE NAME: 4-(2,4-dihydro-1H-indol-3-ylmethyl)-6-(2-fluorophenyl)-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-1-one
CAS Name: 4-(2,4-dihydro-1H-indol-3-ylmethyl)-6-(2-fluorophenyl)-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-1-one
IUPAC NAME: 4-(2,4-dihydro-1H-indol-3-ylmethyl)-6-(2-fluorophenyl)-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-1-one
SYSTEMATIC NAME: 4-(2,4-dihydro-1H-indol-3-ylmethyl)-6-(2-fluorophenyl)-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-1-one
MOLECULAR FORMULA: C25H18FN5O
MOLECULAR WEIGHT: 423.441723
SMILES: C1C=CC=C2C1=C(CN2)CC3=C4N=NC(=O)N4C5=CC=CC=C5C(=N3)C6=CC=CC=C6F
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Product OPENEYE NAME: 1H-1,2-benzodiazepin-4-ylurea
CAS Name: 1H-1,2-benzodiazepin-4-ylurea
IUPAC NAME: 1H-1,2-benzodiazepin-4-ylurea
SYSTEMATIC NAME: 1-(1H-1,2-benzodiazepin-4-yl)urea
MOLECULAR FORMULA: C10H10N4O
MOLECULAR WEIGHT: 202.2126
SMILES: C1=CC=C2C(=C1)C=C(C=NN2)NC(=O)N
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Product OPENEYE NAME: 1H-1,2-benzodiazepin-4-amine; formic acid
CAS Name: 1H-1,2-benzodiazepin-4-amine; formic acid
IUPAC NAME: 1H-1,2-benzodiazepin-4-amine; formic acid
SYSTEMATIC NAME: 1H-1,2-benzodiazepin-4-amine; methanoic acid
MOLECULAR FORMULA: C10H11N3O2
MOLECULAR WEIGHT: 205.21324
SMILES: C1=CC=C2C(=C1)C=C(C=NN2)N.C(=O)O
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Product OPENEYE NAME: 1H-1,2-benzodiazepin-4-amine
CAS Name: 1H-1,2-benzodiazepin-4-amine
IUPAC NAME: 1H-1,2-benzodiazepin-4-amine
SYSTEMATIC NAME: 1H-1,2-benzodiazepin-4-amine
MOLECULAR FORMULA: C9H9N3
MOLECULAR WEIGHT: 159.18786
SMILES: C1=CC=C2C(=C1)C=C(C=NN2)N
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Product OPENEYE NAME: 6-(2-fluorophenyl)-4-[2,2,2-trichloro-1-(1H-indol-3-yl)ethyl]-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine
CAS Name: 6-(2-fluorophenyl)-4-[2,2,2-trichloro-1-(1H-indol-3-yl)ethyl]-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine
IUPAC NAME: 6-(2-fluorophenyl)-4-[2,2,2-trichloro-1-(1H-indol-3-yl)ethyl]-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine
SYSTEMATIC NAME: 6-(2-fluorophenyl)-4-[2,2,2-tris(chloranyl)-1-(1H-indol-3-yl)ethyl]-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine
MOLECULAR FORMULA: C26H17Cl3FN5
MOLECULAR WEIGHT: 524.804083
SMILES: C1=CC=C2C(=C1)C(=CN2)C(C3C4=NN=CN4C5=CC=CC=C5C(=N3)C6=CC=CC=C6F)C(Cl)(Cl)Cl
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Product OPENEYE NAME: 1-[3-[(5-phenyl-3H-1,4-benzodiazepin-2-yl)amino]propyl]pyrrolidin-2-one
CAS Name: 1-[3-[(5-phenyl-3H-1,4-benzodiazepin-2-yl)amino]propyl]-2-pyrrolidinone
IUPAC NAME: 1-[3-[(5-phenyl-3H-1,4-benzodiazepin-2-yl)amino]propyl]pyrrolidin-2-one
SYSTEMATIC NAME: 1-[3-[(5-phenyl-3H-1,4-benzodiazepin-2-yl)amino]propyl]pyrrolidin-2-one
MOLECULAR FORMULA: C22H24N4O
MOLECULAR WEIGHT: 360.45216
SMILES: C1CC(=O)N(C1)CCCNC2=NC3=CC=CC=C3C(=NC2)C4=CC=CC=C4
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