N-[2-(4-chlorophenyl)sulfanyl-5-(3,5-dimethylpiperidin-1-yl)carbonyl-phenyl]ethanamide

Systemtic Name: N-[2-(4-chlorophenyl)sulfanyl-5-(3,5-dimethylpiperidin-1-yl)carbonyl-phenyl]ethanamide Openeye Name: N-[2-(4-chlorophenyl)sulfanyl-5-(3,5-dimethylpiperidine-1-carbonyl)phenyl]acetamide CAS Name: N-[2-[(4-chlorophenyl)thio]-5-[(3,5-dimethyl-1-piperidinyl)-oxomethyl]phenyl]acetamide IUPAC Name: N-[2-(4-chlorophenyl)sulfanyl-5-(3,5-dimethylpiperidine-1-carbonyl)phenyl]acetamide Traditional Name: N-[2-[(4-chlorophenyl)thio]-5-(3,5-dimethylpiperidine-1-carbonyl)phenyl]acetamide Formula: C22H25ClN2O2S MolecularWeight: 416.9641

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=O)C2=CC(=C(C=C2)SC3=CC=C(C=C3)Cl)NC(=O)C)C

Isomeric SMILES

CC1CC(CN(C1)C(=O)C2=CC(=C(C=C2)SC3=CC=C(C=C3)Cl)NC(=O)C)C

InChI

InChI=1S/C22H25ClN2O2S/c1-14-10-15(2)13-25(12-14)22(27)17-4-9-21(20(11-17)24-16(3)26)28-19-7-5-18(23)6-8-19/h4-9,11,14-15H,10,12-13H2,1-3H3,(H,24,26)