(3S)-1-(4-chlorophenyl)carbonyl-N-(4-methoxyphenyl)-N-(thiophen-2-ylmethyl)piperidine-3-carboxamide

Systemtic Name: (3S)-1-(4-chlorophenyl)carbonyl-N-(4-methoxyphenyl)-N-(thiophen-2-ylmethyl)piperidine-3-carboxamide Openeye Name: (3S)-1-(4-chlorobenzoyl)-N-(4-methoxyphenyl)-N-(2-thienylmethyl)piperidine-3-carboxamide CAS Name: (3S)-1-[(4-chlorophenyl)-oxomethyl]-N-(4-methoxyphenyl)-N-(thiophen-2-ylmethyl)-3-piperidinecarboxamide IUPAC Name: (3S)-1-(4-chlorobenzoyl)-N-(4-methoxyphenyl)-N-(thiophen-2-ylmethyl)piperidine-3-carboxamide Traditional Name: (3S)-1-(4-chlorobenzoyl)-N-(4-methoxyphenyl)-N-(2-thenyl)nipecotamide Formula: C25H25ClN2O3S MolecularWeight: 468.9956

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N(CC2=CC=CS2)C(=O)C3CCCN(C3)C(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

COC1=CC=C(C=C1)N(CC2=CC=CS2)C(=O)[C@H]3CCCN(C3)C(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H25ClN2O3S/c1-31-22-12-10-21(11-13-22)28(17-23-5-3-15-32-23)25(30)19-4-2-14-27(16-19)24(29)18-6-8-20(26)9-7-18/h3,5-13,15,19H,2,4,14,16-17H2,1H3/t19-/m0/s1