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

Systemtic Name: N-(2,4-dimethylphenyl)-3-(4-methylsulfanylphenyl)carbonyl-piperidine-1-carboxamide Openeye Name: N-(2,4-dimethylphenyl)-3-(4-methylsulfanylbenzoyl)piperidine-1-carboxamide CAS Name: N-(2,4-dimethylphenyl)-3-[[4-(methylthio)phenyl]-oxomethyl]-1-piperidinecarboxamide IUPAC Name: N-(2,4-dimethylphenyl)-3-(4-methylsulfanylbenzoyl)piperidine-1-carboxamide Traditional Name: N-(2,4-dimethylphenyl)-3-[4-(methylthio)benzoyl]piperidine-1-carboxamide Formula: C22H26N2O2S MolecularWeight: 382.51904

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)N2CCCC(C2)C(=O)C3=CC=C(C=C3)SC)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)N2CCCC(C2)C(=O)C3=CC=C(C=C3)SC)C

InChI

InChI=1S/C22H26N2O2S/c1-15-6-11-20(16(2)13-15)23-22(26)24-12-4-5-18(14-24)21(25)17-7-9-19(27-3)10-8-17/h6-11,13,18H,4-5,12,14H2,1-3H3,(H,23,26)