(3R)-1-(4-methylphenyl)sulfonyl-N-(2-methylsulfanylphenyl)piperidine-3-carboxamide

Systemtic Name: (3R)-1-(4-methylphenyl)sulfonyl-N-(2-methylsulfanylphenyl)piperidine-3-carboxamide Openeye Name: (3R)-N-(2-methylsulfanylphenyl)-1-(p-tolylsulfonyl)piperidine-3-carboxamide CAS Name: (3R)-1-(4-methylphenyl)sulfonyl-N-[2-(methylthio)phenyl]-3-piperidinecarboxamide IUPAC Name: (3R)-1-(4-methylphenyl)sulfonyl-N-(2-methylsulfanylphenyl)piperidine-3-carboxamide Traditional Name: (3R)-N-[2-(methylthio)phenyl]-1-tosyl-nipecotamide Formula: C20H24N2O3S2 MolecularWeight: 404.54616

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2)C(=O)NC3=CC=CC=C3SC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC[C@H](C2)C(=O)NC3=CC=CC=C3SC

InChI

InChI=1S/C20H24N2O3S2/c1-15-9-11-17(12-10-15)27(24,25)22-13-5-6-16(14-22)20(23)21-18-7-3-4-8-19(18)26-2/h3-4,7-12,16H,5-6,13-14H2,1-2H3,(H,21,23)/t16-/m1/s1