[3-[(4-methylcyclohexyl)carbonyl-(1-methylpiperidin-4-yl)amino]-5-phenyl-thiophen-2-yl]carbonyloxymethyl pyrrolidine-2-carboxylate

Systemtic Name: [3-[(4-methylcyclohexyl)carbonyl-(1-methylpiperidin-4-yl)amino]-5-phenyl-thiophen-2-yl]carbonyloxymethyl pyrrolidine-2-carboxylate Openeye Name: [3-[(4-methylcyclohexanecarbonyl)-(1-methyl-4-piperidyl)amino]-5-phenyl-thiophene-2-carbonyl]oxymethyl pyrrolidine-2-carboxylate CAS Name: 2-pyrrolidinecarboxylic acid [[3-[[(4-methylcyclohexyl)-oxomethyl]-(1-methyl-4-piperidinyl)amino]-5-phenyl-2-thiophenyl]-oxomethoxy]methyl ester IUPAC Name: [3-[(4-methylcyclohexanecarbonyl)-(1-methylpiperidin-4-yl)amino]-5-phenylthiophene-2-carbonyl]oxymethyl pyrrolidine-2-carboxylate Traditional Name: pyrrolidine-2-carboxylic acid [3-[(4-methylcyclohexanecarbonyl)-(1-methyl-4-piperidyl)amino]-5-phenyl-thiophene-2-carbonyl]oxymethyl ester Formula: C31H41N3O5S MolecularWeight: 567.73934

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)C(=O)N(C2CCN(CC2)C)C3=C(SC(=C3)C4=CC=CC=C4)C(=O)OCOC(=O)C5CCCN5

Isomeric SMILES

CC1CCC(CC1)C(=O)N(C2CCN(CC2)C)C3=C(SC(=C3)C4=CC=CC=C4)C(=O)OCOC(=O)C5CCCN5

InChI

InChI=1S/C31H41N3O5S/c1-21-10-12-23(13-11-21)29(35)34(24-14-17-33(2)18-15-24)26-19-27(22-7-4-3-5-8-22)40-28(26)31(37)39-20-38-30(36)25-9-6-16-32-25/h3-5,7-8,19,21,23-25,32H,6,9-18,20H2,1-2H3