Product OPENEYE NAME: methyl 1-[2-[4-(difluoromethoxy)anilino]-2-oxo-ethyl]piperidin-1-ium-4-carboxylate
CAS Name: 1-[2-[4-(difluoromethoxy)anilino]-2-oxoethyl]-4-piperidin-1-iumcarboxylic acid methyl ester
IUPAC NAME: methyl 1-[2-[4-(difluoromethoxy)anilino]-2-oxoethyl]piperidin-1-ium-4-carboxylate
SYSTEMATIC NAME: methyl 1-[2-[[4-[bis(fluoranyl)methoxy]phenyl]amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxylate
MOLECULAR FORMULA: C16H21F2N2O4+
MOLECULAR WEIGHT: 343.345746
SMILES: COC(=O)C1CC[NH+](CC1)CC(=O)NC2=CC=C(C=C2)OC(F)F
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Product OPENEYE NAME: methyl 1-[2-[4-(difluoromethoxy)anilino]-2-oxo-ethyl]piperidine-4-carboxylate
CAS Name: 1-[2-[4-(difluoromethoxy)anilino]-2-oxoethyl]-4-piperidinecarboxylic acid methyl ester
IUPAC NAME: methyl 1-[2-[4-(difluoromethoxy)anilino]-2-oxoethyl]piperidine-4-carboxylate
SYSTEMATIC NAME: methyl 1-[2-[[4-[bis(fluoranyl)methoxy]phenyl]amino]-2-oxidanylidene-ethyl]piperidine-4-carboxylate
MOLECULAR FORMULA: C16H20F2N2O4
MOLECULAR WEIGHT: 342.337806
SMILES: COC(=O)C1CCN(CC1)CC(=O)NC2=CC=C(C=C2)OC(F)F
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Product OPENEYE NAME: [2-(4-ethylphenyl)-2-oxo-ethyl] 2H-chromene-3-carboxylate
CAS Name: 2H-1-benzopyran-3-carboxylic acid [2-(4-ethylphenyl)-2-oxoethyl] ester
IUPAC NAME: [2-(4-ethylphenyl)-2-oxoethyl] 2H-chromene-3-carboxylate
SYSTEMATIC NAME: [2-(4-ethylphenyl)-2-oxidanylidene-ethyl] 2H-chromene-3-carboxylate
MOLECULAR FORMULA: C20H18O4
MOLECULAR WEIGHT: 322.35452
SMILES: CCC1=CC=C(C=C1)C(=O)COC(=O)C2=CC3=CC=CC=C3OC2
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Product OPENEYE NAME: methyl 1-[(2-phenylthiazol-4-yl)methyl]piperidin-1-ium-4-carboxylate
CAS Name: 1-[(2-phenyl-4-thiazolyl)methyl]-4-piperidin-1-iumcarboxylic acid methyl ester
IUPAC NAME: methyl 1-[(2-phenyl-1,3-thiazol-4-yl)methyl]piperidin-1-ium-4-carboxylate
SYSTEMATIC NAME: methyl 1-[(2-phenyl-1,3-thiazol-4-yl)methyl]piperidin-1-ium-4-carboxylate
MOLECULAR FORMULA: C17H21N2O2S+
MOLECULAR WEIGHT: 317.42584
SMILES: COC(=O)C1CC[NH+](CC1)CC2=CSC(=N2)C3=CC=CC=C3
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Product OPENEYE NAME: methyl 1-[(2-phenylthiazol-4-yl)methyl]piperidine-4-carboxylate
CAS Name: 1-[(2-phenyl-4-thiazolyl)methyl]-4-piperidinecarboxylic acid methyl ester
IUPAC NAME: methyl 1-[(2-phenyl-1,3-thiazol-4-yl)methyl]piperidine-4-carboxylate
SYSTEMATIC NAME: methyl 1-[(2-phenyl-1,3-thiazol-4-yl)methyl]piperidine-4-carboxylate
MOLECULAR FORMULA: C17H20N2O2S
MOLECULAR WEIGHT: 316.4179
SMILES: COC(=O)C1CCN(CC1)CC2=CSC(=N2)C3=CC=CC=C3
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Product OPENEYE NAME: methyl 2-(benzylcarbamothioylamino)-4,5-dimethyl-thiophene-3-carboxylate
CAS Name: 4,5-dimethyl-2-[[[(phenylmethyl)amino]-sulfanylidenemethyl]amino]-3-thiophenecarboxylic acid methyl ester
IUPAC NAME: methyl 2-(benzylcarbamothioylamino)-4,5-dimethylthiophene-3-carboxylate
SYSTEMATIC NAME: methyl 4,5-dimethyl-2-[(phenylmethyl)carbamothioylamino]thiophene-3-carboxylate
MOLECULAR FORMULA: C16H18N2O2S2
MOLECULAR WEIGHT: 334.45632
SMILES: CC1=C(SC(=C1C(=O)OC)NC(=S)NCC2=CC=CC=C2)C
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Product OPENEYE NAME: methyl 1-[2-[(3-methoxycarbonyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)amino]-2-oxo-ethyl]piperidin-1-ium-4-carboxylate
CAS Name: 1-[2-[(3-methoxycarbonyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)amino]-2-oxoethyl]-4-piperidin-1-iumcarboxylic acid methyl ester
IUPAC NAME: methyl 1-[2-[(3-methoxycarbonyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)amino]-2-oxoethyl]piperidin-1-ium-4-carboxylate
SYSTEMATIC NAME: methyl 1-[2-[(3-methoxycarbonyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxylate
MOLECULAR FORMULA: C20H29N2O5S+
MOLECULAR WEIGHT: 409.51966
SMILES: COC(=O)C1CC[NH+](CC1)CC(=O)NC2=C(C3=C(S2)CCCCC3)C(=O)OC
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Product OPENEYE NAME: methyl 1-[2-[(3-methoxycarbonyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)amino]-2-oxo-ethyl]piperidine-4-carboxylate
CAS Name: 1-[2-[(3-methoxycarbonyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)amino]-2-oxoethyl]-4-piperidinecarboxylic acid methyl ester
IUPAC NAME: methyl 1-[2-[(3-methoxycarbonyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)amino]-2-oxoethyl]piperidine-4-carboxylate
SYSTEMATIC NAME: methyl 1-[2-[(3-methoxycarbonyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)amino]-2-oxidanylidene-ethyl]piperidine-4-carboxylate
MOLECULAR FORMULA: C20H28N2O5S
MOLECULAR WEIGHT: 408.51172
SMILES: COC(=O)C1CCN(CC1)CC(=O)NC2=C(C3=C(S2)CCCCC3)C(=O)OC
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Product OPENEYE NAME: [2-oxo-2-(4-sulfamoylanilino)ethyl] 2H-chromene-3-carboxylate
CAS Name: 2H-1-benzopyran-3-carboxylic acid [2-oxo-2-(4-sulfamoylanilino)ethyl] ester
IUPAC NAME: [2-oxo-2-(4-sulfamoylanilino)ethyl] 2H-chromene-3-carboxylate
SYSTEMATIC NAME: [2-oxidanylidene-2-[(4-sulfamoylphenyl)amino]ethyl] 2H-chromene-3-carboxylate
MOLECULAR FORMULA: C18H16N2O6S
MOLECULAR WEIGHT: 388.39444
SMILES: C1C(=CC2=CC=CC=C2O1)C(=O)OCC(=O)NC3=CC=C(C=C3)S(=O)(=O)N
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Product OPENEYE NAME: [(1S)-1-methyl-2-oxo-2-[(1,3,5-trimethylpyrazol-4-yl)amino]ethyl] 4-(4-chlorophenyl)sulfanylbutanoate
CAS Name: 4-[(4-chlorophenyl)thio]butanoic acid [(2S)-1-oxo-1-[(1,3,5-trimethyl-4-pyrazolyl)amino]propan-2-yl] ester
IUPAC NAME: [(2S)-1-oxo-1-[(1,3,5-trimethylpyrazol-4-yl)amino]propan-2-yl] 4-(4-chlorophenyl)sulfanylbutanoate
SYSTEMATIC NAME: [(2S)-1-oxidanylidene-1-[(1,3,5-trimethylpyrazol-4-yl)amino]propan-2-yl] 4-(4-chlorophenyl)sulfanylbutanoate
MOLECULAR FORMULA: C19H24ClN3O3S
MOLECULAR WEIGHT: 409.93016
SMILES: CC1=C(C(=NN1C)C)NC(=O)[C@H](C)OC(=O)CCCSC2=CC=C(C=C2)Cl
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Product OPENEYE NAME: methyl 4,5-dimethyl-2-(2-phenylethylcarbamothioylamino)thiophene-3-carboxylate
CAS Name: 4,5-dimethyl-2-[[(2-phenylethylamino)-sulfanylidenemethyl]amino]-3-thiophenecarboxylic acid methyl ester
IUPAC NAME: methyl 4,5-dimethyl-2-(2-phenylethylcarbamothioylamino)thiophene-3-carboxylate
SYSTEMATIC NAME: methyl 4,5-dimethyl-2-(2-phenylethylcarbamothioylamino)thiophene-3-carboxylate
MOLECULAR FORMULA: C17H20N2O2S2
MOLECULAR WEIGHT: 348.4829
SMILES: CC1=C(SC(=C1C(=O)OC)NC(=S)NCCC2=CC=CC=C2)C
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Product OPENEYE NAME: methyl 1-[2-[(3-methoxycarbonyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)amino]-2-oxo-ethyl]piperidin-1-ium-4-carboxylate
CAS Name: 1-[2-[(3-methoxycarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl]-4-piperidin-1-iumcarboxylic acid methyl ester
IUPAC NAME: methyl 1-[2-[(3-methoxycarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl]piperidin-1-ium-4-carboxylate
SYSTEMATIC NAME: methyl 1-[2-[(3-methoxycarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxylate
MOLECULAR FORMULA: C19H27N2O5S+
MOLECULAR WEIGHT: 395.49308
SMILES: COC(=O)C1CC[NH+](CC1)CC(=O)NC2=C(C3=C(S2)CCCC3)C(=O)OC
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Product OPENEYE NAME: methyl 1-[2-[(3-methoxycarbonyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)amino]-2-oxo-ethyl]piperidine-4-carboxylate
CAS Name: 1-[2-[(3-methoxycarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl]-4-piperidinecarboxylic acid methyl ester
IUPAC NAME: methyl 1-[2-[(3-methoxycarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl]piperidine-4-carboxylate
SYSTEMATIC NAME: methyl 1-[2-[(3-methoxycarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxidanylidene-ethyl]piperidine-4-carboxylate
MOLECULAR FORMULA: C19H26N2O5S
MOLECULAR WEIGHT: 394.48514
SMILES: COC(=O)C1CCN(CC1)CC(=O)NC2=C(C3=C(S2)CCCC3)C(=O)OC
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Product OPENEYE NAME: [2-oxo-2-(3-sulfamoylanilino)ethyl] 2H-chromene-3-carboxylate
CAS Name: 2H-1-benzopyran-3-carboxylic acid [2-oxo-2-(3-sulfamoylanilino)ethyl] ester
IUPAC NAME: [2-oxo-2-(3-sulfamoylanilino)ethyl] 2H-chromene-3-carboxylate
SYSTEMATIC NAME: [2-oxidanylidene-2-[(3-sulfamoylphenyl)amino]ethyl] 2H-chromene-3-carboxylate
MOLECULAR FORMULA: C18H16N2O6S
MOLECULAR WEIGHT: 388.39444
SMILES: C1C(=CC2=CC=CC=C2O1)C(=O)OCC(=O)NC3=CC(=CC=C3)S(=O)(=O)N
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Product OPENEYE NAME: methyl 1-[2-(2-methyl-1H-indol-3-yl)-2-oxo-ethyl]piperidin-1-ium-4-carboxylate
CAS Name: 1-[2-(2-methyl-1H-indol-3-yl)-2-oxoethyl]-4-piperidin-1-iumcarboxylic acid methyl ester
IUPAC NAME: methyl 1-[2-(2-methyl-1H-indol-3-yl)-2-oxoethyl]piperidin-1-ium-4-carboxylate
SYSTEMATIC NAME: methyl 1-[2-(2-methyl-1H-indol-3-yl)-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxylate
MOLECULAR FORMULA: C18H23N2O3+
MOLECULAR WEIGHT: 315.38682
SMILES: CC1=C(C2=CC=CC=C2N1)C(=O)C[NH+]3CCC(CC3)C(=O)OC
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Product OPENEYE NAME: methyl 1-[2-(2-methyl-1H-indol-3-yl)-2-oxo-ethyl]piperidine-4-carboxylate
CAS Name: 1-[2-(2-methyl-1H-indol-3-yl)-2-oxoethyl]-4-piperidinecarboxylic acid methyl ester
IUPAC NAME: methyl 1-[2-(2-methyl-1H-indol-3-yl)-2-oxoethyl]piperidine-4-carboxylate
SYSTEMATIC NAME: methyl 1-[2-(2-methyl-1H-indol-3-yl)-2-oxidanylidene-ethyl]piperidine-4-carboxylate
MOLECULAR FORMULA: C18H22N2O3
MOLECULAR WEIGHT: 314.37888
SMILES: CC1=C(C2=CC=CC=C2N1)C(=O)CN3CCC(CC3)C(=O)OC
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Product OPENEYE NAME: methyl 2-(isopropylcarbamothioylamino)-4,5-dimethyl-thiophene-3-carboxylate
CAS Name: 4,5-dimethyl-2-[[(propan-2-ylamino)-sulfanylidenemethyl]amino]-3-thiophenecarboxylic acid methyl ester
IUPAC NAME: methyl 4,5-dimethyl-2-(propan-2-ylcarbamothioylamino)thiophene-3-carboxylate
SYSTEMATIC NAME: methyl 4,5-dimethyl-2-(propan-2-ylcarbamothioylamino)thiophene-3-carboxylate
MOLECULAR FORMULA: C12H18N2O2S2
MOLECULAR WEIGHT: 286.41352
SMILES: CC1=C(SC(=C1C(=O)OC)NC(=S)NC(C)C)C
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Product OPENEYE NAME: 3-(4-chlorophenyl)-5-[[5-(2-thienyl)isoxazol-3-yl]methylsulfanyl]-1,2,4-triazol-4-amine
CAS Name: 3-(4-chlorophenyl)-5-[(5-thiophen-2-yl-3-isoxazolyl)methylthio]-1,2,4-triazol-4-amine
IUPAC NAME: 3-(4-chlorophenyl)-5-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methylsulfanyl]-1,2,4-triazol-4-amine
SYSTEMATIC NAME: 3-(4-chlorophenyl)-5-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methylsulfanyl]-1,2,4-triazol-4-amine
MOLECULAR FORMULA: C16H12ClN5OS2
MOLECULAR WEIGHT: 389.88238
SMILES: C1=CSC(=C1)C2=CC(=NO2)CSC3=NN=C(N3N)C4=CC=C(C=C4)Cl
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Product OPENEYE NAME: methyl 1-[2-[(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)amino]-2-oxo-ethyl]piperidin-1-ium-4-carboxylate
CAS Name: 1-[2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl]-4-piperidin-1-iumcarboxylic acid methyl ester
IUPAC NAME: methyl 1-[2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl]piperidin-1-ium-4-carboxylate
SYSTEMATIC NAME: methyl 1-[2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxylate
MOLECULAR FORMULA: C18H24N3O3S+
MOLECULAR WEIGHT: 362.46646
SMILES: COC(=O)C1CC[NH+](CC1)CC(=O)NC2=C(C3=C(S2)CCCC3)C#N
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Product OPENEYE NAME: methyl 1-[2-[(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)amino]-2-oxo-ethyl]piperidine-4-carboxylate
CAS Name: 1-[2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl]-4-piperidinecarboxylic acid methyl ester
IUPAC NAME: methyl 1-[2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl]piperidine-4-carboxylate
SYSTEMATIC NAME: methyl 1-[2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxidanylidene-ethyl]piperidine-4-carboxylate
MOLECULAR FORMULA: C18H23N3O3S
MOLECULAR WEIGHT: 361.45852
SMILES: COC(=O)C1CCN(CC1)CC(=O)NC2=C(C3=C(S2)CCCC3)C#N
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