[phenyl(propan-2-yloxycarbonyloxy)methyl] 3-[(4-methylcyclohexyl)carbonyl-(1-methylpiperidin-4-yl)amino]-5-phenyl-thiophene-2-carboxylate

Systemtic Name: [phenyl(propan-2-yloxycarbonyloxy)methyl] 3-[(4-methylcyclohexyl)carbonyl-(1-methylpiperidin-4-yl)amino]-5-phenyl-thiophene-2-carboxylate Openeye Name: [isopropoxycarbonyloxy(phenyl)methyl] 3-[(4-methylcyclohexanecarbonyl)-(1-methyl-4-piperidyl)amino]-5-phenyl-thiophene-2-carboxylate CAS Name: 3-[[(4-methylcyclohexyl)-oxomethyl]-(1-methyl-4-piperidinyl)amino]-5-phenyl-2-thiophenecarboxylic acid [[oxo(propan-2-yloxy)methoxy]-phenylmethyl] ester IUPAC Name: [phenyl(propan-2-yloxycarbonyloxy)methyl] 3-[(4-methylcyclohexanecarbonyl)-(1-methylpiperidin-4-yl)amino]-5-phenylthiophene-2-carboxylate Traditional Name: 3-[(4-methylcyclohexanecarbonyl)-(1-methyl-4-piperidyl)amino]-5-phenyl-thiophene-2-carboxylic acid [isopropoxycarbonyloxy(phenyl)methyl] ester Formula: C36H44N2O6S MolecularWeight: 632.80936

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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)OC(C5=CC=CC=C5)OC(=O)OC(C)C

Isomeric SMILES

CC1CCC(CC1)C(=O)N(C2CCN(CC2)C)C3=C(SC(=C3)C4=CC=CC=C4)C(=O)OC(C5=CC=CC=C5)OC(=O)OC(C)C

InChI

InChI=1S/C36H44N2O6S/c1-24(2)42-36(41)44-35(28-13-9-6-10-14-28)43-34(40)32-30(23-31(45-32)26-11-7-5-8-12-26)38(29-19-21-37(4)22-20-29)33(39)27-17-15-25(3)16-18-27/h5-14,23-25,27,29,35H,15-22H2,1-4H3