N-[(S)-cyclopropyl-(4-methylphenyl)methyl]-1-(phenylsulfonyl)piperidine-4-carboxamide

Systemtic Name: N-[(S)-cyclopropyl-(4-methylphenyl)methyl]-1-(phenylsulfonyl)piperidine-4-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-[(S)-cyclopropyl(p-tolyl)methyl]piperidine-4-carboxamide CAS Name: 1-(benzenesulfonyl)-N-[(S)-cyclopropyl-(4-methylphenyl)methyl]-4-piperidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-[(S)-cyclopropyl-(4-methylphenyl)methyl]piperidine-4-carboxamide Traditional Name: 1-besyl-N-[(S)-cyclopropyl(p-tolyl)methyl]isonipecotamide Formula: C23H28N2O3S MolecularWeight: 412.54502

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2CC2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)[C@H](C2CC2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H28N2O3S/c1-17-7-9-18(10-8-17)22(19-11-12-19)24-23(26)20-13-15-25(16-14-20)29(27,28)21-5-3-2-4-6-21/h2-10,19-20,22H,11-16H2,1H3,(H,24,26)/t22-/m1/s1