Product OPENEYE NAME: methyl 1-[2-(2,6-diisopropylanilino)-2-oxo-ethyl]piperidin-1-ium-4-carboxylate
CAS Name: 1-[2-[2,6-di(propan-2-yl)anilino]-2-oxoethyl]-4-piperidin-1-iumcarboxylic acid methyl ester
IUPAC NAME: methyl 1-[2-[2,6-di(propan-2-yl)anilino]-2-oxoethyl]piperidin-1-ium-4-carboxylate
SYSTEMATIC NAME: methyl 1-[2-[[2,6-di(propan-2-yl)phenyl]amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxylate
MOLECULAR FORMULA: C21H33N2O3+
MOLECULAR WEIGHT: 361.49832
SMILES: CC(C)C1=C(C(=CC=C1)C(C)C)NC(=O)C[NH+]2CCC(CC2)C(=O)OC
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Product OPENEYE NAME: methyl 1-[2-(2,6-diisopropylanilino)-2-oxo-ethyl]piperidine-4-carboxylate
CAS Name: 1-[2-[2,6-di(propan-2-yl)anilino]-2-oxoethyl]-4-piperidinecarboxylic acid methyl ester
IUPAC NAME: methyl 1-[2-[2,6-di(propan-2-yl)anilino]-2-oxoethyl]piperidine-4-carboxylate
SYSTEMATIC NAME: methyl 1-[2-[[2,6-di(propan-2-yl)phenyl]amino]-2-oxidanylidene-ethyl]piperidine-4-carboxylate
MOLECULAR FORMULA: C21H32N2O3
MOLECULAR WEIGHT: 360.49038
SMILES: CC(C)C1=C(C(=CC=C1)C(C)C)NC(=O)CN2CCC(CC2)C(=O)OC
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Product OPENEYE NAME: methyl 1-[2-(4-butoxycarbonylanilino)-2-oxo-ethyl]piperidin-1-ium-4-carboxylate
CAS Name: 1-[2-[4-[butoxy(oxo)methyl]anilino]-2-oxoethyl]-4-piperidin-1-iumcarboxylic acid methyl ester
IUPAC NAME: methyl 1-[2-(4-butoxycarbonylanilino)-2-oxoethyl]piperidin-1-ium-4-carboxylate
SYSTEMATIC NAME: methyl 1-[2-[(4-butoxycarbonylphenyl)amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxylate
MOLECULAR FORMULA: C20H29N2O5+
MOLECULAR WEIGHT: 377.45466
SMILES: CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C[NH+]2CCC(CC2)C(=O)OC
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Product OPENEYE NAME: methyl 1-[2-(4-butoxycarbonylanilino)-2-oxo-ethyl]piperidine-4-carboxylate
CAS Name: 1-[2-[4-[butoxy(oxo)methyl]anilino]-2-oxoethyl]-4-piperidinecarboxylic acid methyl ester
IUPAC NAME: methyl 1-[2-(4-butoxycarbonylanilino)-2-oxoethyl]piperidine-4-carboxylate
SYSTEMATIC NAME: methyl 1-[2-[(4-butoxycarbonylphenyl)amino]-2-oxidanylidene-ethyl]piperidine-4-carboxylate
MOLECULAR FORMULA: C20H28N2O5
MOLECULAR WEIGHT: 376.44672
SMILES: CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CN2CCC(CC2)C(=O)OC
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Product OPENEYE NAME: [2-(2-methoxyphenyl)-2-oxo-ethyl] 2H-chromene-3-carboxylate
CAS Name: 2H-1-benzopyran-3-carboxylic acid [2-(2-methoxyphenyl)-2-oxoethyl] ester
IUPAC NAME: [2-(2-methoxyphenyl)-2-oxoethyl] 2H-chromene-3-carboxylate
SYSTEMATIC NAME: [2-(2-methoxyphenyl)-2-oxidanylidene-ethyl] 2H-chromene-3-carboxylate
MOLECULAR FORMULA: C19H16O5
MOLECULAR WEIGHT: 324.32734
SMILES: COC1=CC=CC=C1C(=O)COC(=O)C2=CC3=CC=CC=C3OC2
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Product OPENEYE NAME: 3-(4-chlorophenyl)-5-[[2-(3-thienyl)thiazol-4-yl]methylsulfanyl]-1,2,4-triazol-4-amine
CAS Name: 3-(4-chlorophenyl)-5-[[2-(3-thiophenyl)-4-thiazolyl]methylthio]-1,2,4-triazol-4-amine
IUPAC NAME: 3-(4-chlorophenyl)-5-[(2-thiophen-3-yl-1,3-thiazol-4-yl)methylsulfanyl]-1,2,4-triazol-4-amine
SYSTEMATIC NAME: 3-(4-chlorophenyl)-5-[(2-thiophen-3-yl-1,3-thiazol-4-yl)methylsulfanyl]-1,2,4-triazol-4-amine
MOLECULAR FORMULA: C16H12ClN5S3
MOLECULAR WEIGHT: 405.94798
SMILES: C1=CC(=CC=C1C2=NN=C(N2N)SCC3=CSC(=N3)C4=CSC=C4)Cl
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Product OPENEYE NAME: methyl 1-[2-[[(1S)-1-(1-adamantyl)ethyl]amino]-2-oxo-ethyl]piperidin-1-ium-4-carboxylate
CAS Name: 1-[2-[[(1S)-1-(1-adamantyl)ethyl]amino]-2-oxoethyl]-4-piperidin-1-iumcarboxylic acid methyl ester
IUPAC NAME: methyl 1-[2-[[(1S)-1-(1-adamantyl)ethyl]amino]-2-oxoethyl]piperidin-1-ium-4-carboxylate
SYSTEMATIC NAME: methyl 1-[2-[[(1S)-1-(1-adamantyl)ethyl]amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxylate
MOLECULAR FORMULA: C21H35N2O3+
MOLECULAR WEIGHT: 363.5142
SMILES: C[C@@H](C12CC3CC(C1)CC(C3)C2)NC(=O)C[NH+]4CCC(CC4)C(=O)OC
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Product OPENEYE NAME: methyl 1-[2-[[(1S)-1-(1-adamantyl)ethyl]amino]-2-oxo-ethyl]piperidine-4-carboxylate
CAS Name: 1-[2-[[(1S)-1-(1-adamantyl)ethyl]amino]-2-oxoethyl]-4-piperidinecarboxylic acid methyl ester
IUPAC NAME: methyl 1-[2-[[(1S)-1-(1-adamantyl)ethyl]amino]-2-oxoethyl]piperidine-4-carboxylate
SYSTEMATIC NAME: methyl 1-[2-[[(1S)-1-(1-adamantyl)ethyl]amino]-2-oxidanylidene-ethyl]piperidine-4-carboxylate
MOLECULAR FORMULA: C21H34N2O3
MOLECULAR WEIGHT: 362.50626
SMILES: C[C@@H](C12CC3CC(C1)CC(C3)C2)NC(=O)CN4CCC(CC4)C(=O)OC
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Product OPENEYE NAME: methyl 1-[2-[[(1R)-1-(1-adamantyl)ethyl]amino]-2-oxo-ethyl]piperidin-1-ium-4-carboxylate
CAS Name: 1-[2-[[(1R)-1-(1-adamantyl)ethyl]amino]-2-oxoethyl]-4-piperidin-1-iumcarboxylic acid methyl ester
IUPAC NAME: methyl 1-[2-[[(1R)-1-(1-adamantyl)ethyl]amino]-2-oxoethyl]piperidin-1-ium-4-carboxylate
SYSTEMATIC NAME: methyl 1-[2-[[(1R)-1-(1-adamantyl)ethyl]amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxylate
MOLECULAR FORMULA: C21H35N2O3+
MOLECULAR WEIGHT: 363.5142
SMILES: C[C@H](C12CC3CC(C1)CC(C3)C2)NC(=O)C[NH+]4CCC(CC4)C(=O)OC
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Product OPENEYE NAME: methyl 1-[2-[[(1R)-1-(1-adamantyl)ethyl]amino]-2-oxo-ethyl]piperidine-4-carboxylate
CAS Name: 1-[2-[[(1R)-1-(1-adamantyl)ethyl]amino]-2-oxoethyl]-4-piperidinecarboxylic acid methyl ester
IUPAC NAME: methyl 1-[2-[[(1R)-1-(1-adamantyl)ethyl]amino]-2-oxoethyl]piperidine-4-carboxylate
SYSTEMATIC NAME: methyl 1-[2-[[(1R)-1-(1-adamantyl)ethyl]amino]-2-oxidanylidene-ethyl]piperidine-4-carboxylate
MOLECULAR FORMULA: C21H34N2O3
MOLECULAR WEIGHT: 362.50626
SMILES: C[C@H](C12CC3CC(C1)CC(C3)C2)NC(=O)CN4CCC(CC4)C(=O)OC
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Product OPENEYE NAME: [2-(2,6-diisopropylanilino)-2-oxo-ethyl] 2H-chromene-3-carboxylate
CAS Name: 2H-1-benzopyran-3-carboxylic acid [2-[2,6-di(propan-2-yl)anilino]-2-oxoethyl] ester
IUPAC NAME: [2-[2,6-di(propan-2-yl)anilino]-2-oxoethyl] 2H-chromene-3-carboxylate
SYSTEMATIC NAME: [2-[[2,6-di(propan-2-yl)phenyl]amino]-2-oxidanylidene-ethyl] 2H-chromene-3-carboxylate
MOLECULAR FORMULA: C24H27NO4
MOLECULAR WEIGHT: 393.47548
SMILES: CC(C)C1=C(C(=CC=C1)C(C)C)NC(=O)COC(=O)C2=CC3=CC=CC=C3OC2
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Product OPENEYE NAME: methyl 1-[2-(2-acetylanilino)-2-oxo-ethyl]piperidin-1-ium-4-carboxylate
CAS Name: 1-[2-(2-acetylanilino)-2-oxoethyl]-4-piperidin-1-iumcarboxylic acid methyl ester
IUPAC NAME: methyl 1-[2-(2-acetylanilino)-2-oxoethyl]piperidin-1-ium-4-carboxylate
SYSTEMATIC NAME: methyl 1-[2-[(2-ethanoylphenyl)amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxylate
MOLECULAR FORMULA: C17H23N2O4+
MOLECULAR WEIGHT: 319.37552
SMILES: CC(=O)C1=CC=CC=C1NC(=O)C[NH+]2CCC(CC2)C(=O)OC
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Product OPENEYE NAME: methyl 1-[2-(2-acetylanilino)-2-oxo-ethyl]piperidine-4-carboxylate
CAS Name: 1-[2-(2-acetylanilino)-2-oxoethyl]-4-piperidinecarboxylic acid methyl ester
IUPAC NAME: methyl 1-[2-(2-acetylanilino)-2-oxoethyl]piperidine-4-carboxylate
SYSTEMATIC NAME: methyl 1-[2-[(2-ethanoylphenyl)amino]-2-oxidanylidene-ethyl]piperidine-4-carboxylate
MOLECULAR FORMULA: C17H22N2O4
MOLECULAR WEIGHT: 318.36758
SMILES: CC(=O)C1=CC=CC=C1NC(=O)CN2CCC(CC2)C(=O)OC
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Product OPENEYE NAME: 3-(quinazolin-4-ylsulfanylmethyl)-5-(2-thienyl)isoxazole
CAS Name: 3-[(4-quinazolinylthio)methyl]-5-thiophen-2-ylisoxazole
IUPAC NAME: 3-(quinazolin-4-ylsulfanylmethyl)-5-thiophen-2-yl-1,2-oxazole
SYSTEMATIC NAME: 3-(quinazolin-4-ylsulfanylmethyl)-5-thiophen-2-yl-1,2-oxazole
MOLECULAR FORMULA: C16H11N3OS2
MOLECULAR WEIGHT: 325.40804
SMILES: C1=CC=C2C(=C1)C(=NC=N2)SCC3=NOC(=C3)C4=CC=CS4
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Product OPENEYE NAME: methyl 2-[(3-chloro-4-fluoro-phenyl)carbamothioylamino]-4,5-dimethyl-thiophene-3-carboxylate
CAS Name: 2-[[(3-chloro-4-fluoroanilino)-sulfanylidenemethyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid methyl ester
IUPAC NAME: methyl 2-[(3-chloro-4-fluorophenyl)carbamothioylamino]-4,5-dimethylthiophene-3-carboxylate
SYSTEMATIC NAME: methyl 2-[(3-chloranyl-4-fluoranyl-phenyl)carbamothioylamino]-4,5-dimethyl-thiophene-3-carboxylate
MOLECULAR FORMULA: C15H14ClFN2O2S2
MOLECULAR WEIGHT: 372.865263
SMILES: CC1=C(SC(=C1C(=O)OC)NC(=S)NC2=CC(=C(C=C2)F)Cl)C
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Product OPENEYE NAME: methyl 2-[(3-chloro-4-methyl-phenyl)carbamothioylamino]-4,5-dimethyl-thiophene-3-carboxylate
CAS Name: 2-[[(3-chloro-4-methylanilino)-sulfanylidenemethyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid methyl ester
IUPAC NAME: methyl 2-[(3-chloro-4-methylphenyl)carbamothioylamino]-4,5-dimethylthiophene-3-carboxylate
SYSTEMATIC NAME: methyl 2-[(3-chloranyl-4-methyl-phenyl)carbamothioylamino]-4,5-dimethyl-thiophene-3-carboxylate
MOLECULAR FORMULA: C16H17ClN2O2S2
MOLECULAR WEIGHT: 368.90138
SMILES: CC1=C(C=C(C=C1)NC(=S)NC2=C(C(=C(S2)C)C)C(=O)OC)Cl
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Product OPENEYE NAME: methyl 1-[2-[2-(3,4-diethoxyphenyl)ethylamino]-2-oxo-ethyl]piperidin-1-ium-4-carboxylate
CAS Name: 1-[2-[2-(3,4-diethoxyphenyl)ethylamino]-2-oxoethyl]-4-piperidin-1-iumcarboxylic acid methyl ester
IUPAC NAME: methyl 1-[2-[2-(3,4-diethoxyphenyl)ethylamino]-2-oxoethyl]piperidin-1-ium-4-carboxylate
SYSTEMATIC NAME: methyl 1-[2-[2-(3,4-diethoxyphenyl)ethylamino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxylate
MOLECULAR FORMULA: C21H33N2O5+
MOLECULAR WEIGHT: 393.49712
SMILES: CCOC1=C(C=C(C=C1)CCNC(=O)C[NH+]2CCC(CC2)C(=O)OC)OCC
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Product OPENEYE NAME: methyl 1-[2-[2-(3,4-diethoxyphenyl)ethylamino]-2-oxo-ethyl]piperidine-4-carboxylate
CAS Name: 1-[2-[2-(3,4-diethoxyphenyl)ethylamino]-2-oxoethyl]-4-piperidinecarboxylic acid methyl ester
IUPAC NAME: methyl 1-[2-[2-(3,4-diethoxyphenyl)ethylamino]-2-oxoethyl]piperidine-4-carboxylate
SYSTEMATIC NAME: methyl 1-[2-[2-(3,4-diethoxyphenyl)ethylamino]-2-oxidanylidene-ethyl]piperidine-4-carboxylate
MOLECULAR FORMULA: C21H32N2O5
MOLECULAR WEIGHT: 392.48918
SMILES: CCOC1=C(C=C(C=C1)CCNC(=O)CN2CCC(CC2)C(=O)OC)OCC
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Product OPENEYE NAME: 1-[4-(2-quinazolin-4-ylsulfanylacetyl)phenyl]pyrrolidin-2-one
CAS Name: 1-[4-[1-oxo-2-(4-quinazolinylthio)ethyl]phenyl]-2-pyrrolidinone
IUPAC NAME: 1-[4-(2-quinazolin-4-ylsulfanylacetyl)phenyl]pyrrolidin-2-one
SYSTEMATIC NAME: 1-[4-(2-quinazolin-4-ylsulfanylethanoyl)phenyl]pyrrolidin-2-one
MOLECULAR FORMULA: C20H17N3O2S
MOLECULAR WEIGHT: 363.43288
SMILES: C1CC(=O)N(C1)C2=CC=C(C=C2)C(=O)CSC3=NC=NC4=CC=CC=C43
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Product OPENEYE NAME: 2-(4-bromophenoxy)ethyl 2H-chromene-3-carboxylate
CAS Name: 2H-1-benzopyran-3-carboxylic acid 2-(4-bromophenoxy)ethyl ester
IUPAC NAME: 2-(4-bromophenoxy)ethyl 2H-chromene-3-carboxylate
SYSTEMATIC NAME: 2-(4-bromanylphenoxy)ethyl 2H-chromene-3-carboxylate
MOLECULAR FORMULA: C18H15BrO4
MOLECULAR WEIGHT: 375.2133
SMILES: C1C(=CC2=CC=CC=C2O1)C(=O)OCCOC3=CC=C(C=C3)Br
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Product OPENEYE NAME: 2-(2-furyl)-5-[[4-(p-tolylsulfonyl)piperazin-1-ium-1-yl]methyl]-1,3,4-oxadiazole
CAS Name: 2-(2-furanyl)-5-[[4-(4-methylphenyl)sulfonyl-1-piperazin-1-iumyl]methyl]-1,3,4-oxadiazole
IUPAC NAME: 2-(furan-2-yl)-5-[[4-(4-methylphenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-1,3,4-oxadiazole
SYSTEMATIC NAME: 2-(furan-2-yl)-5-[[4-(4-methylphenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-1,3,4-oxadiazole
MOLECULAR FORMULA: C18H21N4O4S+
MOLECULAR WEIGHT: 389.44874
SMILES: CC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC3=NN=C(O3)C4=CC=CO4
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Product OPENEYE NAME: 2-(2-furyl)-5-[[4-(p-tolylsulfonyl)piperazin-1-yl]methyl]-1,3,4-oxadiazole
CAS Name: 2-(2-furanyl)-5-[[4-(4-methylphenyl)sulfonyl-1-piperazinyl]methyl]-1,3,4-oxadiazole
IUPAC NAME: 2-(furan-2-yl)-5-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]-1,3,4-oxadiazole
SYSTEMATIC NAME: 2-(furan-2-yl)-5-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]-1,3,4-oxadiazole
MOLECULAR FORMULA: C18H20N4O4S
MOLECULAR WEIGHT: 388.4408
SMILES: CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=NN=C(O3)C4=CC=CO4
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Product OPENEYE NAME: (2R)-2-quinazolin-4-ylsulfanyl-N-(1,3,5-trimethylpyrazol-4-yl)propanamide
CAS Name: (2R)-2-(4-quinazolinylthio)-N-(1,3,5-trimethyl-4-pyrazolyl)propanamide
IUPAC NAME: (2R)-2-quinazolin-4-ylsulfanyl-N-(1,3,5-trimethylpyrazol-4-yl)propanamide
SYSTEMATIC NAME: (2R)-2-quinazolin-4-ylsulfanyl-N-(1,3,5-trimethylpyrazol-4-yl)propanamide
MOLECULAR FORMULA: C17H19N5OS
MOLECULAR WEIGHT: 341.43066
SMILES: CC1=C(C(=NN1C)C)NC(=O)[C@@H](C)SC2=NC=NC3=CC=CC=C32
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