N-(2-ethyl-6-methyl-phenyl)-1-(4-methylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(2-ethyl-6-methyl-phenyl)-1-(4-methylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-(2-ethyl-6-methyl-phenyl)-1-(p-tolylsulfonyl)piperidine-4-carboxamide CAS Name: N-(2-ethyl-6-methylphenyl)-1-(4-methylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(2-ethyl-6-methylphenyl)-1-(4-methylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(2-ethyl-6-methyl-phenyl)-1-tosyl-isonipecotamide Formula: C22H28N2O3S MolecularWeight: 400.53432

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C)C

InChI

InChI=1S/C22H28N2O3S/c1-4-18-7-5-6-17(3)21(18)23-22(25)19-12-14-24(15-13-19)28(26,27)20-10-8-16(2)9-11-20/h5-11,19H,4,12-15H2,1-3H3,(H,23,25)