(3S)-N-(3-methylsulfanylphenyl)-1-(phenylsulfonyl)piperidine-3-carboxamide

Systemtic Name: (3S)-N-(3-methylsulfanylphenyl)-1-(phenylsulfonyl)piperidine-3-carboxamide Openeye Name: (3S)-1-(benzenesulfonyl)-N-(3-methylsulfanylphenyl)piperidine-3-carboxamide CAS Name: (3S)-1-(benzenesulfonyl)-N-[3-(methylthio)phenyl]-3-piperidinecarboxamide IUPAC Name: (3S)-1-(benzenesulfonyl)-N-(3-methylsulfanylphenyl)piperidine-3-carboxamide Traditional Name: (3S)-1-besyl-N-[3-(methylthio)phenyl]nipecotamide Formula: C19H22N2O3S2 MolecularWeight: 390.51958

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CSC1=CC=CC(=C1)NC(=O)[C@H]2CCCN(C2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H22N2O3S2/c1-25-17-9-5-8-16(13-17)20-19(22)15-7-6-12-21(14-15)26(23,24)18-10-3-2-4-11-18/h2-5,8-11,13,15H,6-7,12,14H2,1H3,(H,20,22)/t15-/m0/s1