N-[2-[(4-chlorophenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-1-(phenylsulfonyl)piperidine-4-carboxamide

Systemtic Name: N-[2-[(4-chlorophenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-1-(phenylsulfonyl)piperidine-4-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-[2-(4-chloroanilino)-2-oxo-ethyl]-N-methyl-piperidine-4-carboxamide CAS Name: 1-(benzenesulfonyl)-N-[2-(4-chloroanilino)-2-oxoethyl]-N-methyl-4-piperidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-[2-(4-chloroanilino)-2-oxoethyl]-N-methylpiperidine-4-carboxamide Traditional Name: 1-besyl-N-[2-(4-chloroanilino)-2-keto-ethyl]-N-methyl-isonipecotamide Formula: C21H24ClN3O4S MolecularWeight: 449.95096

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1=CC=C(C=C1)Cl)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CN(CC(=O)NC1=CC=C(C=C1)Cl)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H24ClN3O4S/c1-24(15-20(26)23-18-9-7-17(22)8-10-18)21(27)16-11-13-25(14-12-16)30(28,29)19-5-3-2-4-6-19/h2-10,16H,11-15H2,1H3,(H,23,26)