Product OPENEYE NAME: [2-(4-acetylpiperazin-1-yl)-2-oxo-ethyl] 2H-chromene-3-carboxylate
CAS Name: 2H-1-benzopyran-3-carboxylic acid [2-(4-acetyl-1-piperazinyl)-2-oxoethyl] ester
IUPAC NAME: [2-(4-acetylpiperazin-1-yl)-2-oxoethyl] 2H-chromene-3-carboxylate
SYSTEMATIC NAME: [2-(4-ethanoylpiperazin-1-yl)-2-oxidanylidene-ethyl] 2H-chromene-3-carboxylate
MOLECULAR FORMULA: C18H20N2O5
MOLECULAR WEIGHT: 344.3618
SMILES: CC(=O)N1CCN(CC1)C(=O)COC(=O)C2=CC3=CC=CC=C3OC2
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Product OPENEYE NAME: N-[(2R)-2-phenylpropyl]-2-[4-(p-tolylsulfonyl)piperazin-1-ium-1-yl]acetamide
CAS Name: 2-[4-(4-methylphenyl)sulfonyl-1-piperazin-1-iumyl]-N-[(2R)-2-phenylpropyl]acetamide
IUPAC NAME: 2-[4-(4-methylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-[(2R)-2-phenylpropyl]acetamide
SYSTEMATIC NAME: 2-[4-(4-methylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-[(2R)-2-phenylpropyl]ethanamide
MOLECULAR FORMULA: C22H30N3O3S+
MOLECULAR WEIGHT: 416.5569
SMILES: CC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC(=O)NC[C@H](C)C3=CC=CC=C3
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Product OPENEYE NAME: N-[(2R)-2-phenylpropyl]-2-[4-(p-tolylsulfonyl)piperazin-1-yl]acetamide
CAS Name: 2-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-N-[(2R)-2-phenylpropyl]acetamide
IUPAC NAME: 2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-N-[(2R)-2-phenylpropyl]acetamide
SYSTEMATIC NAME: 2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-N-[(2R)-2-phenylpropyl]ethanamide
MOLECULAR FORMULA: C22H29N3O3S
MOLECULAR WEIGHT: 415.54896
SMILES: CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NC[C@H](C)C3=CC=CC=C3
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Product OPENEYE NAME: 3-[2-[[(7R)-3-allyl-7-methyl-4-oxo-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-2-yl]sulfanyl]acetyl]oxazolidin-2-one
CAS Name: 3-[2-[[(7R)-7-methyl-4-oxo-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]thio]-1-oxoethyl]-2-oxazolidinone
IUPAC NAME: 3-[2-[[(7R)-7-methyl-4-oxo-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanyl]acetyl]-1,3-oxazolidin-2-one
SYSTEMATIC NAME: 3-[2-[[(7R)-7-methyl-4-oxidanylidene-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanyl]ethanoyl]-1,3-oxazolidin-2-one
MOLECULAR FORMULA: C19H21N3O4S2
MOLECULAR WEIGHT: 419.51774
SMILES: C[C@@H]1CCC2=C(C1)SC3=C2C(=O)N(C(=N3)SCC(=O)N4CCOC4=O)CC=C
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Product OPENEYE NAME: [2-(butylamino)-2-oxo-ethyl] 2H-chromene-3-carboxylate
CAS Name: 2H-1-benzopyran-3-carboxylic acid [2-(butylamino)-2-oxoethyl] ester
IUPAC NAME: [2-(butylamino)-2-oxoethyl] 2H-chromene-3-carboxylate
SYSTEMATIC NAME: [2-(butylamino)-2-oxidanylidene-ethyl] 2H-chromene-3-carboxylate
MOLECULAR FORMULA: C16H19NO4
MOLECULAR WEIGHT: 289.32636
SMILES: CCCCNC(=O)COC(=O)C1=CC2=CC=CC=C2OC1
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Product OPENEYE NAME: 1-benzhydryl-3-butyl-1-methyl-thiourea
CAS Name: 3-butyl-1-(diphenylmethyl)-1-methylthiourea
IUPAC NAME: 1-benzhydryl-3-butyl-1-methylthiourea
SYSTEMATIC NAME: 3-butyl-1-(diphenylmethyl)-1-methyl-thiourea
MOLECULAR FORMULA: C19H24N2S
MOLECULAR WEIGHT: 312.47226
SMILES: CCCCNC(=S)N(C)C(C1=CC=CC=C1)C2=CC=CC=C2
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Product OPENEYE NAME: (2R)-2-[[(E)-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)prop-2-enoyl]amino]-N-propyl-propanamide
CAS Name: (2R)-2-[[(E)-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)-1-oxoprop-2-enyl]amino]-N-propylpropanamide
IUPAC NAME: (2R)-2-[[(E)-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)prop-2-enoyl]amino]-N-propylpropanamide
SYSTEMATIC NAME: (2R)-2-[[(E)-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)prop-2-enoyl]amino]-N-propyl-propanamide
MOLECULAR FORMULA: C18H24N2O5
MOLECULAR WEIGHT: 348.39356
SMILES: CCCNC(=O)[C@@H](C)NC(=O)/C=C/C1=CC2=C(C(=C1)OC)OCCO2
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Product OPENEYE NAME: 3-[2-[[(7S)-3-allyl-7-methyl-4-oxo-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-2-yl]sulfanyl]acetyl]oxazolidin-2-one
CAS Name: 3-[2-[[(7S)-7-methyl-4-oxo-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]thio]-1-oxoethyl]-2-oxazolidinone
IUPAC NAME: 3-[2-[[(7S)-7-methyl-4-oxo-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanyl]acetyl]-1,3-oxazolidin-2-one
SYSTEMATIC NAME: 3-[2-[[(7S)-7-methyl-4-oxidanylidene-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanyl]ethanoyl]-1,3-oxazolidin-2-one
MOLECULAR FORMULA: C19H21N3O4S2
MOLECULAR WEIGHT: 419.51774
SMILES: C[C@H]1CCC2=C(C1)SC3=C2C(=O)N(C(=N3)SCC(=O)N4CCOC4=O)CC=C
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Product OPENEYE NAME: 3-[[4-(p-tolylsulfonyl)piperazin-1-ium-1-yl]methyl]benzonitrile
CAS Name: 3-[[4-(4-methylphenyl)sulfonyl-1-piperazin-1-iumyl]methyl]benzonitrile
IUPAC NAME: 3-[[4-(4-methylphenyl)sulfonylpiperazin-1-ium-1-yl]methyl]benzonitrile
SYSTEMATIC NAME: 3-[[4-(4-methylphenyl)sulfonylpiperazin-1-ium-1-yl]methyl]benzenecarbonitrile
MOLECULAR FORMULA: C19H22N3O2S+
MOLECULAR WEIGHT: 356.46188
SMILES: CC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC3=CC=CC(=C3)C#N
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Product OPENEYE NAME: 3-[[4-(p-tolylsulfonyl)piperazin-1-yl]methyl]benzonitrile
CAS Name: 3-[[4-(4-methylphenyl)sulfonyl-1-piperazinyl]methyl]benzonitrile
IUPAC NAME: 3-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]benzonitrile
SYSTEMATIC NAME: 3-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]benzenecarbonitrile
MOLECULAR FORMULA: C19H21N3O2S
MOLECULAR WEIGHT: 355.45394
SMILES: CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CC=CC(=C3)C#N
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Product OPENEYE NAME: 2-[4-(p-tolylsulfonyl)piperazin-1-ium-1-yl]acetamide
CAS Name: 2-[4-(4-methylphenyl)sulfonyl-1-piperazin-1-iumyl]acetamide
IUPAC NAME: 2-[4-(4-methylphenyl)sulfonylpiperazin-1-ium-1-yl]acetamide
SYSTEMATIC NAME: 2-[4-(4-methylphenyl)sulfonylpiperazin-1-ium-1-yl]ethanamide
MOLECULAR FORMULA: C13H20N3O3S+
MOLECULAR WEIGHT: 298.3812
SMILES: CC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC(=O)N
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Product OPENEYE NAME: 2-[4-(p-tolylsulfonyl)piperazin-1-yl]acetamide
CAS Name: 2-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]acetamide
IUPAC NAME: 2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]acetamide
SYSTEMATIC NAME: 2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]ethanamide
MOLECULAR FORMULA: C13H19N3O3S
MOLECULAR WEIGHT: 297.37326
SMILES: CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)N
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Product OPENEYE NAME: (2S)-2-[[(E)-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)prop-2-enoyl]amino]-N-propyl-propanamide
CAS Name: (2S)-2-[[(E)-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)-1-oxoprop-2-enyl]amino]-N-propylpropanamide
IUPAC NAME: (2S)-2-[[(E)-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)prop-2-enoyl]amino]-N-propylpropanamide
SYSTEMATIC NAME: (2S)-2-[[(E)-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)prop-2-enoyl]amino]-N-propyl-propanamide
MOLECULAR FORMULA: C18H24N2O5
MOLECULAR WEIGHT: 348.39356
SMILES: CCCNC(=O)[C@H](C)NC(=O)/C=C/C1=CC2=C(C(=C1)OC)OCCO2
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Product OPENEYE NAME: methyl 4-[[4-(p-tolylsulfonyl)piperazin-1-ium-1-yl]methyl]benzoate
CAS Name: 4-[[4-(4-methylphenyl)sulfonyl-1-piperazin-1-iumyl]methyl]benzoic acid methyl ester
IUPAC NAME: methyl 4-[[4-(4-methylphenyl)sulfonylpiperazin-1-ium-1-yl]methyl]benzoate
SYSTEMATIC NAME: methyl 4-[[4-(4-methylphenyl)sulfonylpiperazin-1-ium-1-yl]methyl]benzoate
MOLECULAR FORMULA: C20H25N2O4S+
MOLECULAR WEIGHT: 389.4885
SMILES: CC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC3=CC=C(C=C3)C(=O)OC
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Product OPENEYE NAME: methyl 4-[[4-(p-tolylsulfonyl)piperazin-1-yl]methyl]benzoate
CAS Name: 4-[[4-(4-methylphenyl)sulfonyl-1-piperazinyl]methyl]benzoic acid methyl ester
IUPAC NAME: methyl 4-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]benzoate
SYSTEMATIC NAME: methyl 4-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]benzoate
MOLECULAR FORMULA: C20H24N2O4S
MOLECULAR WEIGHT: 388.48056
SMILES: CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CC=C(C=C3)C(=O)OC
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Product OPENEYE NAME: [2-(isopentylamino)-2-oxo-ethyl] 2H-chromene-3-carboxylate
CAS Name: 2H-1-benzopyran-3-carboxylic acid [2-(3-methylbutylamino)-2-oxoethyl] ester
IUPAC NAME: [2-(3-methylbutylamino)-2-oxoethyl] 2H-chromene-3-carboxylate
SYSTEMATIC NAME: [2-(3-methylbutylamino)-2-oxidanylidene-ethyl] 2H-chromene-3-carboxylate
MOLECULAR FORMULA: C17H21NO4
MOLECULAR WEIGHT: 303.35294
SMILES: CC(C)CCNC(=O)COC(=O)C1=CC2=CC=CC=C2OC1
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Product OPENEYE NAME: [2-oxo-2-(2-oxooxazolidin-3-yl)ethyl] 6-methoxy-2-phenyl-quinoline-4-carboxylate
CAS Name: 6-methoxy-2-phenyl-4-quinolinecarboxylic acid [2-oxo-2-(2-oxo-3-oxazolidinyl)ethyl] ester
IUPAC NAME: [2-oxo-2-(2-oxo-1,3-oxazolidin-3-yl)ethyl] 6-methoxy-2-phenylquinoline-4-carboxylate
SYSTEMATIC NAME: [2-oxidanylidene-2-(2-oxidanylidene-1,3-oxazolidin-3-yl)ethyl] 6-methoxy-2-phenyl-quinoline-4-carboxylate
MOLECULAR FORMULA: C22H18N2O6
MOLECULAR WEIGHT: 406.38812
SMILES: COC1=CC2=C(C=C1)N=C(C=C2C(=O)OCC(=O)N3CCOC3=O)C4=CC=CC=C4
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Product OPENEYE NAME: N-[(1R)-1-methyl-2-oxo-2-(propylamino)ethyl]-4-methylsulfanyl-benzamide
CAS Name: 4-(methylthio)-N-[(2R)-1-oxo-1-(propylamino)propan-2-yl]benzamide
IUPAC NAME: 4-methylsulfanyl-N-[(2R)-1-oxo-1-(propylamino)propan-2-yl]benzamide
SYSTEMATIC NAME: 4-methylsulfanyl-N-[(2R)-1-oxidanylidene-1-(propylamino)propan-2-yl]benzamide
MOLECULAR FORMULA: C14H20N2O2S
MOLECULAR WEIGHT: 280.3858
SMILES: CCCNC(=O)[C@@H](C)NC(=O)C1=CC=C(C=C1)SC
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Product OPENEYE NAME: 2-[2-[4-(p-tolylsulfonyl)piperazin-1-ium-1-yl]ethyl]isoindoline-1,3-dione
CAS Name: 2-[2-[4-(4-methylphenyl)sulfonyl-1-piperazin-1-iumyl]ethyl]isoindole-1,3-dione
IUPAC NAME: 2-[2-[4-(4-methylphenyl)sulfonylpiperazin-1-ium-1-yl]ethyl]isoindole-1,3-dione
SYSTEMATIC NAME: 2-[2-[4-(4-methylphenyl)sulfonylpiperazin-1-ium-1-yl]ethyl]isoindole-1,3-dione
MOLECULAR FORMULA: C21H24N3O4S+
MOLECULAR WEIGHT: 414.49796
SMILES: CC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CCN3C(=O)C4=CC=CC=C4C3=O
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Product OPENEYE NAME: 2-[2-[4-(p-tolylsulfonyl)piperazin-1-yl]ethyl]isoindoline-1,3-dione
CAS Name: 2-[2-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]ethyl]isoindole-1,3-dione
IUPAC NAME: 2-[2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]ethyl]isoindole-1,3-dione
SYSTEMATIC NAME: 2-[2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]ethyl]isoindole-1,3-dione
MOLECULAR FORMULA: C21H23N3O4S
MOLECULAR WEIGHT: 413.49002
SMILES: CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CCN3C(=O)C4=CC=CC=C4C3=O
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Product OPENEYE NAME: 1-benzhydryl-1-methyl-3-(2-methylallyl)thiourea
CAS Name: 1-(diphenylmethyl)-1-methyl-3-(2-methylprop-2-enyl)thiourea
IUPAC NAME: 1-benzhydryl-1-methyl-3-(2-methylprop-2-enyl)thiourea
SYSTEMATIC NAME: 1-(diphenylmethyl)-1-methyl-3-(2-methylprop-2-enyl)thiourea
MOLECULAR FORMULA: C19H22N2S
MOLECULAR WEIGHT: 310.45638
SMILES: CC(=C)CNC(=S)N(C)C(C1=CC=CC=C1)C2=CC=CC=C2
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Product OPENEYE NAME: N-[(1S)-1-methyl-2-oxo-2-(propylamino)ethyl]-4-methylsulfanyl-benzamide
CAS Name: 4-(methylthio)-N-[(2S)-1-oxo-1-(propylamino)propan-2-yl]benzamide
IUPAC NAME: 4-methylsulfanyl-N-[(2S)-1-oxo-1-(propylamino)propan-2-yl]benzamide
SYSTEMATIC NAME: 4-methylsulfanyl-N-[(2S)-1-oxidanylidene-1-(propylamino)propan-2-yl]benzamide
MOLECULAR FORMULA: C14H20N2O2S
MOLECULAR WEIGHT: 280.3858
SMILES: CCCNC(=O)[C@H](C)NC(=O)C1=CC=C(C=C1)SC
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Product OPENEYE NAME: N-(1-adamantyl)-2-[4-(p-tolylsulfonyl)piperazin-1-ium-1-yl]acetamide
CAS Name: N-(1-adamantyl)-2-[4-(4-methylphenyl)sulfonyl-1-piperazin-1-iumyl]acetamide
IUPAC NAME: N-(1-adamantyl)-2-[4-(4-methylphenyl)sulfonylpiperazin-1-ium-1-yl]acetamide
SYSTEMATIC NAME: N-(1-adamantyl)-2-[4-(4-methylphenyl)sulfonylpiperazin-1-ium-1-yl]ethanamide
MOLECULAR FORMULA: C23H34N3O3S+
MOLECULAR WEIGHT: 432.59936
SMILES: CC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC(=O)NC34CC5CC(C3)CC(C5)C4
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Product OPENEYE NAME: N-(1-adamantyl)-2-[4-(p-tolylsulfonyl)piperazin-1-yl]acetamide
CAS Name: N-(1-adamantyl)-2-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]acetamide
IUPAC NAME: N-(1-adamantyl)-2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]acetamide
SYSTEMATIC NAME: N-(1-adamantyl)-2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]ethanamide
MOLECULAR FORMULA: C23H33N3O3S
MOLECULAR WEIGHT: 431.59142
SMILES: CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NC34CC5CC(C3)CC(C5)C4
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