(3S)-1-(2-methoxy-5-methyl-phenyl)sulfonyl-N-[(4-methylphenyl)methyl]piperidine-3-carboxamide

Systemtic Name: (3S)-1-(2-methoxy-5-methyl-phenyl)sulfonyl-N-[(4-methylphenyl)methyl]piperidine-3-carboxamide Openeye Name: (3S)-1-(2-methoxy-5-methyl-phenyl)sulfonyl-N-(p-tolylmethyl)piperidine-3-carboxamide CAS Name: (3S)-1-(2-methoxy-5-methylphenyl)sulfonyl-N-[(4-methylphenyl)methyl]-3-piperidinecarboxamide IUPAC Name: (3S)-1-(2-methoxy-5-methylphenyl)sulfonyl-N-[(4-methylphenyl)methyl]piperidine-3-carboxamide Traditional Name: (3S)-1-(2-methoxy-5-methyl-phenyl)sulfonyl-N-(4-methylbenzyl)nipecotamide Formula: C22H28N2O4S MolecularWeight: 416.53372

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C2CCCN(C2)S(=O)(=O)C3=C(C=CC(=C3)C)OC

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)[C@H]2CCCN(C2)S(=O)(=O)C3=C(C=CC(=C3)C)OC

InChI

InChI=1S/C22H28N2O4S/c1-16-6-9-18(10-7-16)14-23-22(25)19-5-4-12-24(15-19)29(26,27)21-13-17(2)8-11-20(21)28-3/h6-11,13,19H,4-5,12,14-15H2,1-3H3,(H,23,25)/t19-/m0/s1