1-(4-methylphenyl)carbonyl-N-(2-methylsulfanylphenyl)piperidine-3-carboxamide

Systemtic Name: 1-(4-methylphenyl)carbonyl-N-(2-methylsulfanylphenyl)piperidine-3-carboxamide Openeye Name: 1-(4-methylbenzoyl)-N-(2-methylsulfanylphenyl)piperidine-3-carboxamide CAS Name: 1-[(4-methylphenyl)-oxomethyl]-N-[2-(methylthio)phenyl]-3-piperidinecarboxamide IUPAC Name: 1-(4-methylbenzoyl)-N-(2-methylsulfanylphenyl)piperidine-3-carboxamide Traditional Name: N-[2-(methylthio)phenyl]-1-p-toluoyl-nipecotamide Formula: C21H24N2O2S MolecularWeight: 368.49246

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CCCC(C2)C(=O)NC3=CC=CC=C3SC

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CCCC(C2)C(=O)NC3=CC=CC=C3SC

InChI

InChI=1S/C21H24N2O2S/c1-15-9-11-16(12-10-15)21(25)23-13-5-6-17(14-23)20(24)22-18-7-3-4-8-19(18)26-2/h3-4,7-12,17H,5-6,13-14H2,1-2H3,(H,22,24)