Product OPENEYE NAME: N-(4-fluorophenyl)-1-methyl-6-oxo-pyridazine-3-carboxamide
CAS Name: N-(4-fluorophenyl)-1-methyl-6-oxo-3-pyridazinecarboxamide
IUPAC NAME: N-(4-fluorophenyl)-1-methyl-6-oxopyridazine-3-carboxamide
SYSTEMATIC NAME: N-(4-fluorophenyl)-1-methyl-6-oxidanylidene-pyridazine-3-carboxamide
MOLECULAR FORMULA: C12H10FN3O2
MOLECULAR WEIGHT: 247.225103
SMILES: CN1C(=O)C=CC(=N1)C(=O)NC2=CC=C(C=C2)F
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Product OPENEYE NAME: N-(2,6-dimethylphenyl)-2-[4-[(2-phenylthiazol-4-yl)methyl]piperazine-1,4-diium-1-yl]acetamide
CAS Name: N-(2,6-dimethylphenyl)-2-[4-[(2-phenyl-4-thiazolyl)methyl]-1-piperazine-1,4-diiumyl]acetamide
IUPAC NAME: N-(2,6-dimethylphenyl)-2-[4-[(2-phenyl-1,3-thiazol-4-yl)methyl]piperazine-1,4-diium-1-yl]acetamide
SYSTEMATIC NAME: N-(2,6-dimethylphenyl)-2-[4-[(2-phenyl-1,3-thiazol-4-yl)methyl]piperazine-1,4-diium-1-yl]ethanamide
MOLECULAR FORMULA: C24H30N4OS+2
MOLECULAR WEIGHT: 422.5862
SMILES: CC1=C(C(=CC=C1)C)NC(=O)C[NH+]2CC[NH+](CC2)CC3=CSC(=N3)C4=CC=CC=C4
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Product OPENEYE NAME: N-(2,6-dimethylphenyl)-2-[4-[(2-phenylthiazol-4-yl)methyl]piperazin-1-yl]acetamide
CAS Name: N-(2,6-dimethylphenyl)-2-[4-[(2-phenyl-4-thiazolyl)methyl]-1-piperazinyl]acetamide
IUPAC NAME: N-(2,6-dimethylphenyl)-2-[4-[(2-phenyl-1,3-thiazol-4-yl)methyl]piperazin-1-yl]acetamide
SYSTEMATIC NAME: N-(2,6-dimethylphenyl)-2-[4-[(2-phenyl-1,3-thiazol-4-yl)methyl]piperazin-1-yl]ethanamide
MOLECULAR FORMULA: C24H28N4OS
MOLECULAR WEIGHT: 420.57032
SMILES: CC1=C(C(=CC=C1)C)NC(=O)CN2CCN(CC2)CC3=CSC(=N3)C4=CC=CC=C4
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Product OPENEYE NAME: 5-(dimethylsulfamoyl)-2-fluoro-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]benzamide
CAS Name: 5-(dimethylsulfamoyl)-2-fluoro-N-[2-[(2-fluorophenyl)methylthio]ethyl]benzamide
IUPAC NAME: 5-(dimethylsulfamoyl)-2-fluoro-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]benzamide
SYSTEMATIC NAME: 5-(dimethylsulfamoyl)-2-fluoranyl-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]benzamide
MOLECULAR FORMULA: C18H20F2N2O3S2
MOLECULAR WEIGHT: 414.489806
SMILES: CN(C)S(=O)(=O)C1=CC(=C(C=C1)F)C(=O)NCCSCC2=CC=CC=C2F
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Product OPENEYE NAME: [(1R)-1-methyl-2-(3-methylanilino)-2-oxo-ethyl] 2H-chromene-3-carboxylate
CAS Name: 2H-1-benzopyran-3-carboxylic acid [(2R)-1-(3-methylanilino)-1-oxopropan-2-yl] ester
IUPAC NAME: [(2R)-1-(3-methylanilino)-1-oxopropan-2-yl] 2H-chromene-3-carboxylate
SYSTEMATIC NAME: [(2R)-1-[(3-methylphenyl)amino]-1-oxidanylidene-propan-2-yl] 2H-chromene-3-carboxylate
MOLECULAR FORMULA: C20H19NO4
MOLECULAR WEIGHT: 337.36916
SMILES: CC1=CC(=CC=C1)NC(=O)[C@@H](C)OC(=O)C2=CC3=CC=CC=C3OC2
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Product OPENEYE NAME: 2-(1-adamantylmethylcarbamothioylamino)ethyl-dimethyl-ammonium
CAS Name: 2-[[(1-adamantylmethylamino)-sulfanylidenemethyl]amino]ethyl-dimethylammonium
IUPAC NAME: 2-(1-adamantylmethylcarbamothioylamino)ethyl-dimethylazanium
SYSTEMATIC NAME: 2-(1-adamantylmethylcarbamothioylamino)ethyl-dimethyl-azanium
MOLECULAR FORMULA: C16H30N3S+
MOLECULAR WEIGHT: 296.4945
SMILES: C[NH+](C)CCNC(=S)NCC12CC3CC(C1)CC(C3)C2
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Product OPENEYE NAME: 1-(1-adamantylmethyl)-3-[2-(dimethylamino)ethyl]thiourea
CAS Name: 1-(1-adamantylmethyl)-3-[2-(dimethylamino)ethyl]thiourea
IUPAC NAME: 1-(1-adamantylmethyl)-3-[2-(dimethylamino)ethyl]thiourea
SYSTEMATIC NAME: 1-(1-adamantylmethyl)-3-[2-(dimethylamino)ethyl]thiourea
MOLECULAR FORMULA: C16H29N3S
MOLECULAR WEIGHT: 295.48656
SMILES: CN(C)CCNC(=S)NCC12CC3CC(C1)CC(C3)C2
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Product OPENEYE NAME: [(1S)-1-methyl-2-(3-methylanilino)-2-oxo-ethyl] 2H-chromene-3-carboxylate
CAS Name: 2H-1-benzopyran-3-carboxylic acid [(2S)-1-(3-methylanilino)-1-oxopropan-2-yl] ester
IUPAC NAME: [(2S)-1-(3-methylanilino)-1-oxopropan-2-yl] 2H-chromene-3-carboxylate
SYSTEMATIC NAME: [(2S)-1-[(3-methylphenyl)amino]-1-oxidanylidene-propan-2-yl] 2H-chromene-3-carboxylate
MOLECULAR FORMULA: C20H19NO4
MOLECULAR WEIGHT: 337.36916
SMILES: CC1=CC(=CC=C1)NC(=O)[C@H](C)OC(=O)C2=CC3=CC=CC=C3OC2
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Product OPENEYE NAME: N-[(1S)-1-[(4-fluorophenyl)carbamoyl]-3-methylsulfanyl-propyl]-3-nitro-benzamide
CAS Name: N-[(2S)-1-(4-fluoroanilino)-4-(methylthio)-1-oxobutan-2-yl]-3-nitrobenzamide
IUPAC NAME: N-[(2S)-1-(4-fluoroanilino)-4-methylsulfanyl-1-oxobutan-2-yl]-3-nitrobenzamide
SYSTEMATIC NAME: N-[(2S)-1-[(4-fluorophenyl)amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-3-nitro-benzamide
MOLECULAR FORMULA: C18H18FN3O4S
MOLECULAR WEIGHT: 391.416623
SMILES: CSCC[C@@H](C(=O)NC1=CC=C(C=C1)F)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-]
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Product OPENEYE NAME: [2-(3-thienyl)thiazol-4-yl]methyl 3-(methylsulfamoyl)benzoate
CAS Name: 3-(methylsulfamoyl)benzoic acid [2-(3-thiophenyl)-4-thiazolyl]methyl ester
IUPAC NAME: (2-thiophen-3-yl-1,3-thiazol-4-yl)methyl 3-(methylsulfamoyl)benzoate
SYSTEMATIC NAME: (2-thiophen-3-yl-1,3-thiazol-4-yl)methyl 3-(methylsulfamoyl)benzoate
MOLECULAR FORMULA: C16H14N2O4S3
MOLECULAR WEIGHT: 394.48836
SMILES: CNS(=O)(=O)C1=CC=CC(=C1)C(=O)OCC2=CSC(=N2)C3=CSC=C3
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Product OPENEYE NAME: N-(2,6-dimethylphenyl)-2-[4-(p-tolylmethyl)piperazine-1,4-diium-1-yl]acetamide
CAS Name: N-(2,6-dimethylphenyl)-2-[4-[(4-methylphenyl)methyl]-1-piperazine-1,4-diiumyl]acetamide
IUPAC NAME: N-(2,6-dimethylphenyl)-2-[4-[(4-methylphenyl)methyl]piperazine-1,4-diium-1-yl]acetamide
SYSTEMATIC NAME: N-(2,6-dimethylphenyl)-2-[4-[(4-methylphenyl)methyl]piperazine-1,4-diium-1-yl]ethanamide
MOLECULAR FORMULA: C22H31N3O+2
MOLECULAR WEIGHT: 353.50104
SMILES: CC1=CC=C(C=C1)C[NH+]2CC[NH+](CC2)CC(=O)NC3=C(C=CC=C3C)C
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Product OPENEYE NAME: N-(2,6-dimethylphenyl)-2-[4-(p-tolylmethyl)piperazin-1-yl]acetamide
CAS Name: N-(2,6-dimethylphenyl)-2-[4-[(4-methylphenyl)methyl]-1-piperazinyl]acetamide
IUPAC NAME: N-(2,6-dimethylphenyl)-2-[4-[(4-methylphenyl)methyl]piperazin-1-yl]acetamide
SYSTEMATIC NAME: N-(2,6-dimethylphenyl)-2-[4-[(4-methylphenyl)methyl]piperazin-1-yl]ethanamide
MOLECULAR FORMULA: C22H29N3O
MOLECULAR WEIGHT: 351.48516
SMILES: CC1=CC=C(C=C1)CN2CCN(CC2)CC(=O)NC3=C(C=CC=C3C)C
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Product OPENEYE NAME: 2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-(isobutylcarbamoyl)acetamide
CAS Name: 2-[4-(2,5-dimethylphenyl)sulfonyl-1-piperazin-1-iumyl]-N-[(2-methylpropylamino)-oxomethyl]acetamide
IUPAC NAME: 2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-(2-methylpropylcarbamoyl)acetamide
SYSTEMATIC NAME: 2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-(2-methylpropylcarbamoyl)ethanamide
MOLECULAR FORMULA: C19H31N4O4S+
MOLECULAR WEIGHT: 411.53884
SMILES: CC1=CC(=C(C=C1)C)S(=O)(=O)N2CC[NH+](CC2)CC(=O)NC(=O)NCC(C)C
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Product OPENEYE NAME: 2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-N-(isobutylcarbamoyl)acetamide
CAS Name: 2-[4-(2,5-dimethylphenyl)sulfonyl-1-piperazinyl]-N-[(2-methylpropylamino)-oxomethyl]acetamide
IUPAC NAME: 2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-N-(2-methylpropylcarbamoyl)acetamide
SYSTEMATIC NAME: 2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-N-(2-methylpropylcarbamoyl)ethanamide
MOLECULAR FORMULA: C19H30N4O4S
MOLECULAR WEIGHT: 410.5309
SMILES: CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)CC(=O)NC(=O)NCC(C)C
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Product OPENEYE NAME: 1-(1-adamantylmethyl)-3-propyl-thiourea
CAS Name: 1-(1-adamantylmethyl)-3-propylthiourea
IUPAC NAME: 1-(1-adamantylmethyl)-3-propylthiourea
SYSTEMATIC NAME: 1-(1-adamantylmethyl)-3-propyl-thiourea
MOLECULAR FORMULA: C15H26N2S
MOLECULAR WEIGHT: 266.44534
SMILES: CCCNC(=S)NCC12CC3CC(C1)CC(C3)C2
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Product OPENEYE NAME: N-[(1R)-1-[(4-fluorophenyl)carbamoyl]-3-methylsulfanyl-propyl]-3-nitro-benzamide
CAS Name: N-[(2R)-1-(4-fluoroanilino)-4-(methylthio)-1-oxobutan-2-yl]-3-nitrobenzamide
IUPAC NAME: N-[(2R)-1-(4-fluoroanilino)-4-methylsulfanyl-1-oxobutan-2-yl]-3-nitrobenzamide
SYSTEMATIC NAME: N-[(2R)-1-[(4-fluorophenyl)amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-3-nitro-benzamide
MOLECULAR FORMULA: C18H18FN3O4S
MOLECULAR WEIGHT: 391.416623
SMILES: CSCC[C@H](C(=O)NC1=CC=C(C=C1)F)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-]
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Product OPENEYE NAME: 2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-(propylcarbamoyl)acetamide
CAS Name: 2-[4-(2,5-dimethylphenyl)sulfonyl-1-piperazin-1-iumyl]-N-[oxo(propylamino)methyl]acetamide
IUPAC NAME: 2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-(propylcarbamoyl)acetamide
SYSTEMATIC NAME: 2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-(propylcarbamoyl)ethanamide
MOLECULAR FORMULA: C18H29N4O4S+
MOLECULAR WEIGHT: 397.51226
SMILES: CCCNC(=O)NC(=O)C[NH+]1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C)C
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Product OPENEYE NAME: 2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-N-(propylcarbamoyl)acetamide
CAS Name: 2-[4-(2,5-dimethylphenyl)sulfonyl-1-piperazinyl]-N-[oxo(propylamino)methyl]acetamide
IUPAC NAME: 2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-N-(propylcarbamoyl)acetamide
SYSTEMATIC NAME: 2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-N-(propylcarbamoyl)ethanamide
MOLECULAR FORMULA: C18H28N4O4S
MOLECULAR WEIGHT: 396.50432
SMILES: CCCNC(=O)NC(=O)CN1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C)C
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Product OPENEYE NAME: 1-(1-adamantylmethyl)-3-(3-morpholin-4-ium-4-ylpropyl)thiourea
CAS Name: 1-(1-adamantylmethyl)-3-[3-(4-morpholin-4-iumyl)propyl]thiourea
IUPAC NAME: 1-(1-adamantylmethyl)-3-(3-morpholin-4-ium-4-ylpropyl)thiourea
SYSTEMATIC NAME: 1-(1-adamantylmethyl)-3-(3-morpholin-4-ium-4-ylpropyl)thiourea
MOLECULAR FORMULA: C19H34N3OS+
MOLECULAR WEIGHT: 352.55776
SMILES: C1COCC[NH+]1CCCNC(=S)NCC23CC4CC(C2)CC(C4)C3
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Product OPENEYE NAME: 1-(1-adamantylmethyl)-3-(3-morpholinopropyl)thiourea
CAS Name: 1-(1-adamantylmethyl)-3-[3-(4-morpholinyl)propyl]thiourea
IUPAC NAME: 1-(1-adamantylmethyl)-3-(3-morpholin-4-ylpropyl)thiourea
SYSTEMATIC NAME: 1-(1-adamantylmethyl)-3-(3-morpholin-4-ylpropyl)thiourea
MOLECULAR FORMULA: C19H33N3OS
MOLECULAR WEIGHT: 351.54982
SMILES: C1COCCN1CCCNC(=S)NCC23CC4CC(C2)CC(C4)C3
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Product OPENEYE NAME: (2S)-2-(benzenesulfonamido)-N-(4-fluorophenyl)-4-methylsulfanyl-butanamide
CAS Name: (2S)-2-(benzenesulfonamido)-N-(4-fluorophenyl)-4-(methylthio)butanamide
IUPAC NAME: (2S)-2-(benzenesulfonamido)-N-(4-fluorophenyl)-4-methylsulfanylbutanamide
SYSTEMATIC NAME: (2S)-N-(4-fluorophenyl)-4-methylsulfanyl-2-(phenylsulfonylamino)butanamide
MOLECULAR FORMULA: C17H19FN2O3S2
MOLECULAR WEIGHT: 382.472763
SMILES: CSCC[C@@H](C(=O)NC1=CC=C(C=C1)F)NS(=O)(=O)C2=CC=CC=C2
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Product OPENEYE NAME: (2S)-2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]-1-[(3S,5R)-3,5-dimethyl-1-piperidyl]propan-1-one
CAS Name: (2S)-2-[4-(2,5-dimethylphenyl)sulfonyl-1-piperazin-1-iumyl]-1-[(3S,5R)-3,5-dimethyl-1-piperidinyl]-1-propanone
IUPAC NAME: (2S)-2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]-1-[(3S,5R)-3,5-dimethylpiperidin-1-yl]propan-1-one
SYSTEMATIC NAME: (2S)-2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]-1-[(3S,5R)-3,5-dimethylpiperidin-1-yl]propan-1-one
MOLECULAR FORMULA: C22H36N3O3S+
MOLECULAR WEIGHT: 422.60454
SMILES: C[C@@H]1C[C@@H](CN(C1)C(=O)[C@H](C)[NH+]2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)C)C)C
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Product OPENEYE NAME: (2S)-2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-1-[(3R,5S)-3,5-dimethyl-1-piperidyl]propan-1-one
CAS Name: (2S)-2-[4-(2,5-dimethylphenyl)sulfonyl-1-piperazinyl]-1-[(3R,5S)-3,5-dimethyl-1-piperidinyl]-1-propanone
IUPAC NAME: (2S)-2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-1-[(3R,5S)-3,5-dimethylpiperidin-1-yl]propan-1-one
SYSTEMATIC NAME: (2S)-2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-1-[(3R,5S)-3,5-dimethylpiperidin-1-yl]propan-1-one
MOLECULAR FORMULA: C22H35N3O3S
MOLECULAR WEIGHT: 421.5966
SMILES: C[C@@H]1C[C@@H](CN(C1)C(=O)[C@H](C)N2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)C)C)C
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Product OPENEYE NAME: (2R)-2-(benzenesulfonamido)-N-(4-fluorophenyl)-4-methylsulfanyl-butanamide
CAS Name: (2R)-2-(benzenesulfonamido)-N-(4-fluorophenyl)-4-(methylthio)butanamide
IUPAC NAME: (2R)-2-(benzenesulfonamido)-N-(4-fluorophenyl)-4-methylsulfanylbutanamide
SYSTEMATIC NAME: (2R)-N-(4-fluorophenyl)-4-methylsulfanyl-2-(phenylsulfonylamino)butanamide
MOLECULAR FORMULA: C17H19FN2O3S2
MOLECULAR WEIGHT: 382.472763
SMILES: CSCC[C@H](C(=O)NC1=CC=C(C=C1)F)NS(=O)(=O)C2=CC=CC=C2
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