3-(2-methylsulfanylphenyl)carbonyl-N-phenethyl-piperidine-1-carboxamide

Systemtic Name: 3-(2-methylsulfanylphenyl)carbonyl-N-phenethyl-piperidine-1-carboxamide Openeye Name: 3-(2-methylsulfanylbenzoyl)-N-phenethyl-piperidine-1-carboxamide CAS Name: 3-[[2-(methylthio)phenyl]-oxomethyl]-N-phenethyl-1-piperidinecarboxamide IUPAC Name: 3-(2-methylsulfanylbenzoyl)-N-phenethylpiperidine-1-carboxamide Traditional Name: 3-[2-(methylthio)benzoyl]-N-phenethyl-piperidine-1-carboxamide Formula: C22H26N2O2S MolecularWeight: 382.51904

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1C(=O)C2CCCN(C2)C(=O)NCCC3=CC=CC=C3

Isomeric SMILES

CSC1=CC=CC=C1C(=O)C2CCCN(C2)C(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C22H26N2O2S/c1-27-20-12-6-5-11-19(20)21(25)18-10-7-15-24(16-18)22(26)23-14-13-17-8-3-2-4-9-17/h2-6,8-9,11-12,18H,7,10,13-16H2,1H3,(H,23,26)