1-butyl-2-(2-methoxyphenyl)-N-(3-methylsulfanylphenyl)-6-oxidanylidene-piperidine-3-carboxamide

Systemtic Name: 1-butyl-2-(2-methoxyphenyl)-N-(3-methylsulfanylphenyl)-6-oxidanylidene-piperidine-3-carboxamide Openeye Name: 1-butyl-2-(2-methoxyphenyl)-N-(3-methylsulfanylphenyl)-6-oxo-piperidine-3-carboxamide CAS Name: 1-butyl-2-(2-methoxyphenyl)-N-[3-(methylthio)phenyl]-6-oxo-3-piperidinecarboxamide IUPAC Name: 1-butyl-2-(2-methoxyphenyl)-N-(3-methylsulfanylphenyl)-6-oxopiperidine-3-carboxamide Traditional Name: 1-butyl-6-keto-2-(2-methoxyphenyl)-N-[3-(methylthio)phenyl]nipecotamide Formula: C24H30N2O3S MolecularWeight: 426.5716

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(C(CCC1=O)C(=O)NC2=CC(=CC=C2)SC)C3=CC=CC=C3OC

Isomeric SMILES

CCCCN1C(C(CCC1=O)C(=O)NC2=CC(=CC=C2)SC)C3=CC=CC=C3OC

InChI

InChI=1S/C24H30N2O3S/c1-4-5-15-26-22(27)14-13-20(23(26)19-11-6-7-12-21(19)29-2)24(28)25-17-9-8-10-18(16-17)30-3/h6-12,16,20,23H,4-5,13-15H2,1-3H3,(H,25,28)