N-(3-methylsulfanylphenyl)-1-(3-phenylpropylsulfonyl)piperidine-4-carboxamide

Systemtic Name: N-(3-methylsulfanylphenyl)-1-(3-phenylpropylsulfonyl)piperidine-4-carboxamide Openeye Name: N-(3-methylsulfanylphenyl)-1-(3-phenylpropylsulfonyl)piperidine-4-carboxamide CAS Name: N-[3-(methylthio)phenyl]-1-(3-phenylpropylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-(3-methylsulfanylphenyl)-1-(3-phenylpropylsulfonyl)piperidine-4-carboxamide Traditional Name: N-[3-(methylthio)phenyl]-1-(3-phenylpropylsulfonyl)isonipecotamide Formula: C22H28N2O3S2 MolecularWeight: 432.59932

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)NC(=O)C2CCN(CC2)S(=O)(=O)CCCC3=CC=CC=C3

Isomeric SMILES

CSC1=CC=CC(=C1)NC(=O)C2CCN(CC2)S(=O)(=O)CCCC3=CC=CC=C3

InChI

InChI=1S/C22H28N2O3S2/c1-28-21-11-5-10-20(17-21)23-22(25)19-12-14-24(15-13-19)29(26,27)16-6-9-18-7-3-2-4-8-18/h2-5,7-8,10-11,17,19H,6,9,12-16H2,1H3,(H,23,25)