N-[2-[ethyl-(2-methylphenyl)amino]ethyl]-1-(phenylsulfonyl)piperidine-3-carboxamide

Systemtic Name: N-[2-[ethyl-(2-methylphenyl)amino]ethyl]-1-(phenylsulfonyl)piperidine-3-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-[2-(N-ethyl-2-methyl-anilino)ethyl]piperidine-3-carboxamide CAS Name: 1-(benzenesulfonyl)-N-[2-(N-ethyl-2-methylanilino)ethyl]-3-piperidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-[2-(N-ethyl-2-methylanilino)ethyl]piperidine-3-carboxamide Traditional Name: 1-besyl-N-[2-(N-ethyl-2-methyl-anilino)ethyl]nipecotamide Formula: C23H31N3O3S MolecularWeight: 429.57554

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCNC(=O)C1CCCN(C1)S(=O)(=O)C2=CC=CC=C2)C3=CC=CC=C3C

Isomeric SMILES

CCN(CCNC(=O)C1CCCN(C1)S(=O)(=O)C2=CC=CC=C2)C3=CC=CC=C3C

InChI

InChI=1S/C23H31N3O3S/c1-3-25(22-14-8-7-10-19(22)2)17-15-24-23(27)20-11-9-16-26(18-20)30(28,29)21-12-5-4-6-13-21/h4-8,10,12-14,20H,3,9,11,15-18H2,1-2H3,(H,24,27)