N-[(S)-(4-methylphenyl)-thiophen-2-yl-methyl]-1-(phenylsulfonyl)piperidine-4-carboxamide

Systemtic Name: N-[(S)-(4-methylphenyl)-thiophen-2-yl-methyl]-1-(phenylsulfonyl)piperidine-4-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-[(S)-p-tolyl(2-thienyl)methyl]piperidine-4-carboxamide CAS Name: 1-(benzenesulfonyl)-N-[(S)-(4-methylphenyl)-thiophen-2-ylmethyl]-4-piperidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-[(S)-(4-methylphenyl)-thiophen-2-ylmethyl]piperidine-4-carboxamide Traditional Name: 1-besyl-N-[(S)-p-tolyl(2-thienyl)methyl]isonipecotamide Formula: C24H26N2O3S2 MolecularWeight: 454.60484

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)[C@@H](C2=CC=CS2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C24H26N2O3S2/c1-18-9-11-19(12-10-18)23(22-8-5-17-30-22)25-24(27)20-13-15-26(16-14-20)31(28,29)21-6-3-2-4-7-21/h2-12,17,20,23H,13-16H2,1H3,(H,25,27)/t23-/m0/s1