N-(3-methylsulfanylphenyl)-1-methylsulfonyl-piperidine-2-carboxamide

Systemtic Name: N-(3-methylsulfanylphenyl)-1-methylsulfonyl-piperidine-2-carboxamide Openeye Name: N-(3-methylsulfanylphenyl)-1-methylsulfonyl-piperidine-2-carboxamide CAS Name: 1-methylsulfonyl-N-[3-(methylthio)phenyl]-2-piperidinecarboxamide IUPAC Name: N-(3-methylsulfanylphenyl)-1-methylsulfonylpiperidine-2-carboxamide Traditional Name: 1-mesyl-N-[3-(methylthio)phenyl]pipecolinamide Formula: C14H20N2O3S2 MolecularWeight: 328.4502

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20N2O3S2/c1-20-12-7-5-6-11(10-12)15-14(17)13-8-3-4-9-16(13)21(2,18)19/h5-7,10,13H,3-4,8-9H2,1-2H3,(H,15,17)