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

Systemtic Name: (2R)-1-(4-bromophenyl)sulfonyl-N-(3-methylsulfanylphenyl)piperidine-2-carboxamide Openeye Name: (2R)-1-(4-bromophenyl)sulfonyl-N-(3-methylsulfanylphenyl)piperidine-2-carboxamide CAS Name: (2R)-1-(4-bromophenyl)sulfonyl-N-[3-(methylthio)phenyl]-2-piperidinecarboxamide IUPAC Name: (2R)-1-(4-bromophenyl)sulfonyl-N-(3-methylsulfanylphenyl)piperidine-2-carboxamide Traditional Name: (2R)-1-brosyl-N-[3-(methylthio)phenyl]pipecolinamide Formula: C19H21BrN2O3S2 MolecularWeight: 469.41564

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)NC(=O)C2CCCCN2S(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CSC1=CC=CC(=C1)NC(=O)[C@H]2CCCCN2S(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C19H21BrN2O3S2/c1-26-16-6-4-5-15(13-16)21-19(23)18-7-2-3-12-22(18)27(24,25)17-10-8-14(20)9-11-17/h4-6,8-11,13,18H,2-3,7,12H2,1H3,(H,21,23)/t18-/m1/s1