Product OPENEYE NAME: (6-methyl-4-oxo-pyrido[1,2-a]pyrimidin-2-yl)methyl (2S)-2-(butylsulfonylamino)propanoate
CAS Name: (2S)-2-(butylsulfonylamino)propanoic acid (6-methyl-4-oxo-2-pyrido[1,2-a]pyrimidinyl)methyl ester
IUPAC NAME: (6-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl (2S)-2-(butylsulfonylamino)propanoate
SYSTEMATIC NAME: (6-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methyl (2S)-2-(butylsulfonylamino)propanoate
MOLECULAR FORMULA: C17H23N3O5S
MOLECULAR WEIGHT: 381.44662
SMILES: CCCCS(=O)(=O)N[C@@H](C)C(=O)OCC1=CC(=O)N2C(=CC=CC2=N1)C
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Product OPENEYE NAME: N-(2-chloro-3-pyridyl)-2-[4-[2-(2,6-dimethylanilino)-2-oxo-ethyl]piperazine-1,4-diium-1-yl]acetamide
CAS Name: N-(2-chloro-3-pyridinyl)-2-[4-[2-(2,6-dimethylanilino)-2-oxoethyl]-1-piperazine-1,4-diiumyl]acetamide
IUPAC NAME: N-(2-chloropyridin-3-yl)-2-[4-[2-(2,6-dimethylanilino)-2-oxoethyl]piperazine-1,4-diium-1-yl]acetamide
SYSTEMATIC NAME: N-(2-chloranylpyridin-3-yl)-2-[4-[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]piperazine-1,4-diium-1-yl]ethanamide
MOLECULAR FORMULA: C21H28ClN5O2+2
MOLECULAR WEIGHT: 417.93232
SMILES: CC1=C(C(=CC=C1)C)NC(=O)C[NH+]2CC[NH+](CC2)CC(=O)NC3=C(N=CC=C3)Cl
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Product OPENEYE NAME: N-(2-chloro-3-pyridyl)-2-[4-[2-(2,6-dimethylanilino)-2-oxo-ethyl]piperazin-1-yl]acetamide
CAS Name: N-(2-chloro-3-pyridinyl)-2-[4-[2-(2,6-dimethylanilino)-2-oxoethyl]-1-piperazinyl]acetamide
IUPAC NAME: N-(2-chloropyridin-3-yl)-2-[4-[2-(2,6-dimethylanilino)-2-oxoethyl]piperazin-1-yl]acetamide
SYSTEMATIC NAME: N-(2-chloranylpyridin-3-yl)-2-[4-[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]piperazin-1-yl]ethanamide
MOLECULAR FORMULA: C21H26ClN5O2
MOLECULAR WEIGHT: 415.91644
SMILES: CC1=C(C(=CC=C1)C)NC(=O)CN2CCN(CC2)CC(=O)NC3=C(N=CC=C3)Cl
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Product OPENEYE NAME: N-(1-cyanocyclopentyl)-2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]acetamide
CAS Name: N-(1-cyanocyclopentyl)-2-[4-(2,5-dimethylphenyl)sulfonyl-1-piperazin-1-iumyl]acetamide
IUPAC NAME: N-(1-cyanocyclopentyl)-2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]acetamide
SYSTEMATIC NAME: N-(1-cyanocyclopentyl)-2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]ethanamide
MOLECULAR FORMULA: C20H29N4O3S+
MOLECULAR WEIGHT: 405.53426
SMILES: CC1=CC(=C(C=C1)C)S(=O)(=O)N2CC[NH+](CC2)CC(=O)NC3(CCCC3)C#N
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Product OPENEYE NAME: N-(1-cyanocyclopentyl)-2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]acetamide
CAS Name: N-(1-cyanocyclopentyl)-2-[4-(2,5-dimethylphenyl)sulfonyl-1-piperazinyl]acetamide
IUPAC NAME: N-(1-cyanocyclopentyl)-2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]acetamide
SYSTEMATIC NAME: N-(1-cyanocyclopentyl)-2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]ethanamide
MOLECULAR FORMULA: C20H28N4O3S
MOLECULAR WEIGHT: 404.52632
SMILES: CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)CC(=O)NC3(CCCC3)C#N
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Product OPENEYE NAME: (E)-2-cyano-N-(4-fluorophenyl)-3-(1-isobutyl-2,5-dimethyl-pyrrol-3-yl)prop-2-enamide
CAS Name: (E)-2-cyano-3-[2,5-dimethyl-1-(2-methylpropyl)-3-pyrrolyl]-N-(4-fluorophenyl)-2-propenamide
IUPAC NAME: (E)-2-cyano-3-[2,5-dimethyl-1-(2-methylpropyl)pyrrol-3-yl]-N-(4-fluorophenyl)prop-2-enamide
SYSTEMATIC NAME: (E)-2-cyano-3-[2,5-dimethyl-1-(2-methylpropyl)pyrrol-3-yl]-N-(4-fluorophenyl)prop-2-enamide
MOLECULAR FORMULA: C20H22FN3O
MOLECULAR WEIGHT: 339.406583
SMILES: CC1=CC(=C(N1CC(C)C)C)/C=C(\C#N)/C(=O)NC2=CC=C(C=C2)F
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Product OPENEYE NAME: [2-oxo-2-(2,2,2-trifluoroethylamino)ethyl] 2H-chromene-3-carboxylate
CAS Name: 2H-1-benzopyran-3-carboxylic acid [2-oxo-2-(2,2,2-trifluoroethylamino)ethyl] ester
IUPAC NAME: [2-oxo-2-(2,2,2-trifluoroethylamino)ethyl] 2H-chromene-3-carboxylate
SYSTEMATIC NAME: [2-oxidanylidene-2-[2,2,2-tris(fluoranyl)ethylamino]ethyl] 2H-chromene-3-carboxylate
MOLECULAR FORMULA: C14H12F3NO4
MOLECULAR WEIGHT: 315.24459
SMILES: C1C(=CC2=CC=CC=C2O1)C(=O)OCC(=O)NCC(F)(F)F
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Product OPENEYE NAME: methyl 3-[[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]methyl]benzoate
CAS Name: 3-[[4-(2,5-dimethylphenyl)sulfonyl-1-piperazin-1-iumyl]methyl]benzoic acid methyl ester
IUPAC NAME: methyl 3-[[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]methyl]benzoate
SYSTEMATIC NAME: methyl 3-[[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]methyl]benzoate
MOLECULAR FORMULA: C21H27N2O4S+
MOLECULAR WEIGHT: 403.51508
SMILES: CC1=CC(=C(C=C1)C)S(=O)(=O)N2CC[NH+](CC2)CC3=CC=CC(=C3)C(=O)OC
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Product OPENEYE NAME: methyl 3-[[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]methyl]benzoate
CAS Name: 3-[[4-(2,5-dimethylphenyl)sulfonyl-1-piperazinyl]methyl]benzoic acid methyl ester
IUPAC NAME: methyl 3-[[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]methyl]benzoate
SYSTEMATIC NAME: methyl 3-[[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]methyl]benzoate
MOLECULAR FORMULA: C21H26N2O4S
MOLECULAR WEIGHT: 402.50714
SMILES: CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)CC3=CC=CC(=C3)C(=O)OC
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Product OPENEYE NAME: N-allyl-4-(2,5-dimethylphenyl)sulfonyl-piperazine-1-carbothioamide
CAS Name: 4-(2,5-dimethylphenyl)sulfonyl-N-prop-2-enyl-1-piperazinecarbothioamide
IUPAC NAME: 4-(2,5-dimethylphenyl)sulfonyl-N-prop-2-enylpiperazine-1-carbothioamide
SYSTEMATIC NAME: 4-(2,5-dimethylphenyl)sulfonyl-N-prop-2-enyl-piperazine-1-carbothioamide
MOLECULAR FORMULA: C16H23N3O2S2
MOLECULAR WEIGHT: 353.50272
SMILES: CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)C(=S)NCC=C
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Product OPENEYE NAME: N-[2-(cyclohexen-1-yl)ethyl]-2-[4-[2-(2,6-dimethylanilino)-2-oxo-ethyl]piperazine-1,4-diium-1-yl]acetamide
CAS Name: N-[2-(1-cyclohexenyl)ethyl]-2-[4-[2-(2,6-dimethylanilino)-2-oxoethyl]-1-piperazine-1,4-diiumyl]acetamide
IUPAC NAME: N-[2-(cyclohexen-1-yl)ethyl]-2-[4-[2-(2,6-dimethylanilino)-2-oxoethyl]piperazine-1,4-diium-1-yl]acetamide
SYSTEMATIC NAME: N-[2-(cyclohexen-1-yl)ethyl]-2-[4-[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]piperazine-1,4-diium-1-yl]ethanamide
MOLECULAR FORMULA: C24H38N4O2+2
MOLECULAR WEIGHT: 414.58412
SMILES: CC1=C(C(=CC=C1)C)NC(=O)C[NH+]2CC[NH+](CC2)CC(=O)NCCC3=CCCCC3
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Product OPENEYE NAME: N-[2-(cyclohexen-1-yl)ethyl]-2-[4-[2-(2,6-dimethylanilino)-2-oxo-ethyl]piperazin-1-yl]acetamide
CAS Name: N-[2-(1-cyclohexenyl)ethyl]-2-[4-[2-(2,6-dimethylanilino)-2-oxoethyl]-1-piperazinyl]acetamide
IUPAC NAME: N-[2-(cyclohexen-1-yl)ethyl]-2-[4-[2-(2,6-dimethylanilino)-2-oxoethyl]piperazin-1-yl]acetamide
SYSTEMATIC NAME: N-[2-(cyclohexen-1-yl)ethyl]-2-[4-[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]piperazin-1-yl]ethanamide
MOLECULAR FORMULA: C24H36N4O2
MOLECULAR WEIGHT: 412.56824
SMILES: CC1=C(C(=CC=C1)C)NC(=O)CN2CCN(CC2)CC(=O)NCCC3=CCCCC3
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Product OPENEYE NAME: [2-(3-chloro-4-cyano-anilino)-2-oxo-ethyl] 2H-chromene-3-carboxylate
CAS Name: 2H-1-benzopyran-3-carboxylic acid [2-(3-chloro-4-cyanoanilino)-2-oxoethyl] ester
IUPAC NAME: [2-(3-chloro-4-cyanoanilino)-2-oxoethyl] 2H-chromene-3-carboxylate
SYSTEMATIC NAME: [2-[(3-chloranyl-4-cyano-phenyl)amino]-2-oxidanylidene-ethyl] 2H-chromene-3-carboxylate
MOLECULAR FORMULA: C19H13ClN2O4
MOLECULAR WEIGHT: 368.77052
SMILES: C1C(=CC2=CC=CC=C2O1)C(=O)OCC(=O)NC3=CC(=C(C=C3)C#N)Cl
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Product OPENEYE NAME: 5-[[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-3-phenyl-1,2,4-oxadiazole
CAS Name: 5-[[4-(2,5-dimethylphenyl)sulfonyl-1-piperazin-1-iumyl]methyl]-3-phenyl-1,2,4-oxadiazole
IUPAC NAME: 5-[[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-3-phenyl-1,2,4-oxadiazole
SYSTEMATIC NAME: 5-[[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-3-phenyl-1,2,4-oxadiazole
MOLECULAR FORMULA: C21H25N4O3S+
MOLECULAR WEIGHT: 413.5132
SMILES: CC1=CC(=C(C=C1)C)S(=O)(=O)N2CC[NH+](CC2)CC3=NC(=NO3)C4=CC=CC=C4
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Product OPENEYE NAME: 5-[[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]methyl]-3-phenyl-1,2,4-oxadiazole
CAS Name: 5-[[4-(2,5-dimethylphenyl)sulfonyl-1-piperazinyl]methyl]-3-phenyl-1,2,4-oxadiazole
IUPAC NAME: 5-[[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]methyl]-3-phenyl-1,2,4-oxadiazole
SYSTEMATIC NAME: 5-[[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]methyl]-3-phenyl-1,2,4-oxadiazole
MOLECULAR FORMULA: C21H24N4O3S
MOLECULAR WEIGHT: 412.50526
SMILES: CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)CC3=NC(=NO3)C4=CC=CC=C4
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Product OPENEYE NAME: 3-[(1,3-dioxoisoindolin-2-yl)methyl]-N-(4-fluorophenyl)benzamide
CAS Name: 3-[(1,3-dioxo-2-isoindolyl)methyl]-N-(4-fluorophenyl)benzamide
IUPAC NAME: 3-[(1,3-dioxoisoindol-2-yl)methyl]-N-(4-fluorophenyl)benzamide
SYSTEMATIC NAME: 3-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]-N-(4-fluorophenyl)benzamide
MOLECULAR FORMULA: C22H15FN2O3
MOLECULAR WEIGHT: 374.364503
SMILES: C1=CC=C2C(=C1)C(=O)N(C2=O)CC3=CC=CC(=C3)C(=O)NC4=CC=C(C=C4)F
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Product OPENEYE NAME: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-2-methyl-5-methylsulfonyl-benzamide
CAS Name: N-[2-[(2-fluorophenyl)methylthio]ethyl]-2-methyl-5-methylsulfonylbenzamide
IUPAC NAME: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-2-methyl-5-methylsulfonylbenzamide
SYSTEMATIC NAME: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-2-methyl-5-methylsulfonyl-benzamide
MOLECULAR FORMULA: C18H20FNO3S2
MOLECULAR WEIGHT: 381.484703
SMILES: CC1=C(C=C(C=C1)S(=O)(=O)C)C(=O)NCCSCC2=CC=CC=C2F
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Product OPENEYE NAME: 4-(2,5-dimethylphenyl)sulfonyl-N-methyl-piperazine-1-carbothioamide
CAS Name: 4-(2,5-dimethylphenyl)sulfonyl-N-methyl-1-piperazinecarbothioamide
IUPAC NAME: 4-(2,5-dimethylphenyl)sulfonyl-N-methylpiperazine-1-carbothioamide
SYSTEMATIC NAME: 4-(2,5-dimethylphenyl)sulfonyl-N-methyl-piperazine-1-carbothioamide
MOLECULAR FORMULA: C14H21N3O2S2
MOLECULAR WEIGHT: 327.46544
SMILES: CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)C(=S)NC
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Product OPENEYE NAME: 5-[(1,3-dioxoisoindolin-2-yl)methyl]-2-ethoxy-N-(4-fluorophenyl)benzamide
CAS Name: 5-[(1,3-dioxo-2-isoindolyl)methyl]-2-ethoxy-N-(4-fluorophenyl)benzamide
IUPAC NAME: 5-[(1,3-dioxoisoindol-2-yl)methyl]-2-ethoxy-N-(4-fluorophenyl)benzamide
SYSTEMATIC NAME: 5-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]-2-ethoxy-N-(4-fluorophenyl)benzamide
MOLECULAR FORMULA: C24H19FN2O4
MOLECULAR WEIGHT: 418.417063
SMILES: CCOC1=C(C=C(C=C1)CN2C(=O)C3=CC=CC=C3C2=O)C(=O)NC4=CC=C(C=C4)F
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Product OPENEYE NAME: 2-[4-[(5-acetyl-2-ethoxy-phenyl)methyl]piperazine-1,4-diium-1-yl]-N-(2,6-dimethylphenyl)acetamide
CAS Name: 2-[4-[(5-acetyl-2-ethoxyphenyl)methyl]-1-piperazine-1,4-diiumyl]-N-(2,6-dimethylphenyl)acetamide
IUPAC NAME: 2-[4-[(5-acetyl-2-ethoxyphenyl)methyl]piperazine-1,4-diium-1-yl]-N-(2,6-dimethylphenyl)acetamide
SYSTEMATIC NAME: N-(2,6-dimethylphenyl)-2-[4-[(5-ethanoyl-2-ethoxy-phenyl)methyl]piperazine-1,4-diium-1-yl]ethanamide
MOLECULAR FORMULA: C25H35N3O3+2
MOLECULAR WEIGHT: 425.5637
SMILES: CCOC1=C(C=C(C=C1)C(=O)C)C[NH+]2CC[NH+](CC2)CC(=O)NC3=C(C=CC=C3C)C
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Product OPENEYE NAME: 2-[4-[(5-acetyl-2-ethoxy-phenyl)methyl]piperazin-1-yl]-N-(2,6-dimethylphenyl)acetamide
CAS Name: 2-[4-[(5-acetyl-2-ethoxyphenyl)methyl]-1-piperazinyl]-N-(2,6-dimethylphenyl)acetamide
IUPAC NAME: 2-[4-[(5-acetyl-2-ethoxyphenyl)methyl]piperazin-1-yl]-N-(2,6-dimethylphenyl)acetamide
SYSTEMATIC NAME: N-(2,6-dimethylphenyl)-2-[4-[(5-ethanoyl-2-ethoxy-phenyl)methyl]piperazin-1-yl]ethanamide
MOLECULAR FORMULA: C25H33N3O3
MOLECULAR WEIGHT: 423.54782
SMILES: CCOC1=C(C=C(C=C1)C(=O)C)CN2CCN(CC2)CC(=O)NC3=C(C=CC=C3C)C
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Product OPENEYE NAME: [2-(1-adamantylcarbamoylamino)-2-oxo-ethyl] 2H-chromene-3-carboxylate
CAS Name: 2H-1-benzopyran-3-carboxylic acid [2-[[(1-adamantylamino)-oxomethyl]amino]-2-oxoethyl] ester
IUPAC NAME: [2-(1-adamantylcarbamoylamino)-2-oxoethyl] 2H-chromene-3-carboxylate
SYSTEMATIC NAME: [2-(1-adamantylcarbamoylamino)-2-oxidanylidene-ethyl] 2H-chromene-3-carboxylate
MOLECULAR FORMULA: C23H26N2O5
MOLECULAR WEIGHT: 410.46294
SMILES: C1C2CC3CC1CC(C2)(C3)NC(=O)NC(=O)COC(=O)C4=CC5=CC=CC=C5OC4
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Product OPENEYE NAME: methyl N-[2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]acetyl]carbamate
CAS Name: N-[2-[4-(2,5-dimethylphenyl)sulfonyl-1-piperazin-1-iumyl]-1-oxoethyl]carbamic acid methyl ester
IUPAC NAME: methyl N-[2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]acetyl]carbamate
SYSTEMATIC NAME: methyl N-[2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]ethanoyl]carbamate
MOLECULAR FORMULA: C16H24N3O5S+
MOLECULAR WEIGHT: 370.44386
SMILES: CC1=CC(=C(C=C1)C)S(=O)(=O)N2CC[NH+](CC2)CC(=O)NC(=O)OC
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