(3S)-1-(4-methylsulfonylphenyl)carbonyl-N-phenyl-piperidine-3-carboxamide

Systemtic Name: (3S)-1-(4-methylsulfonylphenyl)carbonyl-N-phenyl-piperidine-3-carboxamide Openeye Name: (3S)-1-(4-methylsulfonylbenzoyl)-N-phenyl-piperidine-3-carboxamide CAS Name: (3S)-1-[(4-methylsulfonylphenyl)-oxomethyl]-N-phenyl-3-piperidinecarboxamide IUPAC Name: (3S)-1-(4-methylsulfonylbenzoyl)-N-phenylpiperidine-3-carboxamide Traditional Name: (3S)-1-(4-mesylbenzoyl)-N-phenyl-nipecotamide Formula: C20H22N2O4S MolecularWeight: 386.46468

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C(=O)N2CCCC(C2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C(=O)N2CCC[C@@H](C2)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C20H22N2O4S/c1-27(25,26)18-11-9-15(10-12-18)20(24)22-13-5-6-16(14-22)19(23)21-17-7-3-2-4-8-17/h2-4,7-12,16H,5-6,13-14H2,1H3,(H,21,23)/t16-/m0/s1