N-(4-ethylphenyl)-1-[(2-methylphenyl)methylsulfonyl]piperidine-4-carboxamide

Systemtic Name: N-(4-ethylphenyl)-1-[(2-methylphenyl)methylsulfonyl]piperidine-4-carboxamide Openeye Name: N-(4-ethylphenyl)-1-(o-tolylmethylsulfonyl)piperidine-4-carboxamide CAS Name: N-(4-ethylphenyl)-1-[(2-methylphenyl)methylsulfonyl]-4-piperidinecarboxamide IUPAC Name: N-(4-ethylphenyl)-1-[(2-methylphenyl)methylsulfonyl]piperidine-4-carboxamide Traditional Name: N-(4-ethylphenyl)-1-(2-methylbenzyl)sulfonyl-isonipecotamide Formula: C22H28N2O3S MolecularWeight: 400.53432

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3C

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3C

InChI

InChI=1S/C22H28N2O3S/c1-3-18-8-10-21(11-9-18)23-22(25)19-12-14-24(15-13-19)28(26,27)16-20-7-5-4-6-17(20)2/h4-11,19H,3,12-16H2,1-2H3,(H,23,25)