1-(4-chlorophenyl)carbonyl-N-[(4-propylphenyl)-thiophen-2-yl-methyl]piperidine-4-carboxamide

Systemtic Name: 1-(4-chlorophenyl)carbonyl-N-[(4-propylphenyl)-thiophen-2-yl-methyl]piperidine-4-carboxamide Openeye Name: 1-(4-chlorobenzoyl)-N-[(4-propylphenyl)-(2-thienyl)methyl]piperidine-4-carboxamide CAS Name: 1-[(4-chlorophenyl)-oxomethyl]-N-[(4-propylphenyl)-thiophen-2-ylmethyl]-4-piperidinecarboxamide IUPAC Name: 1-(4-chlorobenzoyl)-N-[(4-propylphenyl)-thiophen-2-ylmethyl]piperidine-4-carboxamide Traditional Name: 1-(4-chlorobenzoyl)-N-[(4-propylphenyl)-(2-thienyl)methyl]isonipecotamide Formula: C27H29ClN2O2S MolecularWeight: 481.04936

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)C3CCN(CC3)C(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CCCC1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)C3CCN(CC3)C(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C27H29ClN2O2S/c1-2-4-19-6-8-20(9-7-19)25(24-5-3-18-33-24)29-26(31)21-14-16-30(17-15-21)27(32)22-10-12-23(28)13-11-22/h3,5-13,18,21,25H,2,4,14-17H2,1H3,(H,29,31)