1-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]-N-(2-methylsulfanylphenyl)piperidine-4-carboxamide

Systemtic Name: 1-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]-N-(2-methylsulfanylphenyl)piperidine-4-carboxamide Openeye Name: 1-[2-(4-methylanilino)-2-oxo-ethyl]-N-(2-methylsulfanylphenyl)piperidine-4-carboxamide CAS Name: 1-[2-(4-methylanilino)-2-oxoethyl]-N-[2-(methylthio)phenyl]-4-piperidinecarboxamide IUPAC Name: 1-[2-(4-methylanilino)-2-oxoethyl]-N-(2-methylsulfanylphenyl)piperidine-4-carboxamide Traditional Name: 1-[2-keto-2-(p-toluidino)ethyl]-N-[2-(methylthio)phenyl]isonipecotamide Formula: C22H27N3O2S MolecularWeight: 397.53368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CN2CCC(CC2)C(=O)NC3=CC=CC=C3SC

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CN2CCC(CC2)C(=O)NC3=CC=CC=C3SC

InChI

InChI=1S/C22H27N3O2S/c1-16-7-9-18(10-8-16)23-21(26)15-25-13-11-17(12-14-25)22(27)24-19-5-3-4-6-20(19)28-2/h3-10,17H,11-15H2,1-2H3,(H,23,26)(H,24,27)