3-[methyl(2-pyridin-2-ylethyl)amino]-N-(2-methylsulfanylphenyl)piperidine-1-carboxamide

Systemtic Name: 3-[methyl(2-pyridin-2-ylethyl)amino]-N-(2-methylsulfanylphenyl)piperidine-1-carboxamide Openeye Name: 3-[methyl-[2-(2-pyridyl)ethyl]amino]-N-(2-methylsulfanylphenyl)piperidine-1-carboxamide CAS Name: 3-[methyl-[2-(2-pyridinyl)ethyl]amino]-N-[2-(methylthio)phenyl]-1-piperidinecarboxamide IUPAC Name: 3-[methyl(2-pyridin-2-ylethyl)amino]-N-(2-methylsulfanylphenyl)piperidine-1-carboxamide Traditional Name: 3-[methyl-[2-(2-pyridyl)ethyl]amino]-N-[2-(methylthio)phenyl]piperidine-1-carboxamide Formula: C21H28N4OS MolecularWeight: 384.53822

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC=CC=N1)C2CCCN(C2)C(=O)NC3=CC=CC=C3SC

Isomeric SMILES

CN(CCC1=CC=CC=N1)C2CCCN(C2)C(=O)NC3=CC=CC=C3SC

InChI

InChI=1S/C21H28N4OS/c1-24(15-12-17-8-5-6-13-22-17)18-9-7-14-25(16-18)21(26)23-19-10-3-4-11-20(19)27-2/h3-6,8,10-11,13,18H,7,9,12,14-16H2,1-2H3,(H,23,26)