N-(4-methylphenyl)-1-(4-methylphenyl)sulfonyl-N-(phenylmethyl)piperidine-4-carboxamide

Systemtic Name: N-(4-methylphenyl)-1-(4-methylphenyl)sulfonyl-N-(phenylmethyl)piperidine-4-carboxamide Openeye Name: N-benzyl-N-(p-tolyl)-1-(p-tolylsulfonyl)piperidine-4-carboxamide CAS Name: N-(4-methylphenyl)-1-(4-methylphenyl)sulfonyl-N-(phenylmethyl)-4-piperidinecarboxamide IUPAC Name: N-benzyl-N-(4-methylphenyl)-1-(4-methylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-benzyl-N-(p-tolyl)-1-tosyl-isonipecotamide Formula: C27H30N2O3S MolecularWeight: 462.6037

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(CC2=CC=CC=C2)C(=O)C3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)N(CC2=CC=CC=C2)C(=O)C3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C27H30N2O3S/c1-21-8-12-25(13-9-21)29(20-23-6-4-3-5-7-23)27(30)24-16-18-28(19-17-24)33(31,32)26-14-10-22(2)11-15-26/h3-15,24H,16-20H2,1-2H3