(3S)-1-(4-chlorophenyl)sulfonyl-N-(4-methylsulfanylphenyl)piperidine-3-carboxamide

Systemtic Name: (3S)-1-(4-chlorophenyl)sulfonyl-N-(4-methylsulfanylphenyl)piperidine-3-carboxamide Openeye Name: (3S)-1-(4-chlorophenyl)sulfonyl-N-(4-methylsulfanylphenyl)piperidine-3-carboxamide CAS Name: (3S)-1-(4-chlorophenyl)sulfonyl-N-[4-(methylthio)phenyl]-3-piperidinecarboxamide IUPAC Name: (3S)-1-(4-chlorophenyl)sulfonyl-N-(4-methylsulfanylphenyl)piperidine-3-carboxamide Traditional Name: (3S)-1-(4-chlorophenyl)sulfonyl-N-[4-(methylthio)phenyl]nipecotamide Formula: C19H21ClN2O3S2 MolecularWeight: 424.96464

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21ClN2O3S2/c1-26-17-8-6-16(7-9-17)21-19(23)14-3-2-12-22(13-14)27(24,25)18-10-4-15(20)5-11-18/h4-11,14H,2-3,12-13H2,1H3,(H,21,23)/t14-/m0/s1