3-(4-chlorophenyl)sulfanyl-N-[4-(3-methylpiperidin-1-yl)sulfonylphenyl]propanamide

Systemtic Name: 3-(4-chlorophenyl)sulfanyl-N-[4-(3-methylpiperidin-1-yl)sulfonylphenyl]propanamide Openeye Name: 3-(4-chlorophenyl)sulfanyl-N-[4-[(3-methyl-1-piperidyl)sulfonyl]phenyl]propanamide CAS Name: 3-[(4-chlorophenyl)thio]-N-[4-[(3-methyl-1-piperidinyl)sulfonyl]phenyl]propanamide IUPAC Name: 3-(4-chlorophenyl)sulfanyl-N-[4-(3-methylpiperidin-1-yl)sulfonylphenyl]propanamide Traditional Name: 3-[(4-chlorophenyl)thio]-N-[4-(3-methylpiperidino)sulfonylphenyl]propionamide Formula: C21H25ClN2O3S2 MolecularWeight: 453.0178

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CCSC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CCSC3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H25ClN2O3S2/c1-16-3-2-13-24(15-16)29(26,27)20-10-6-18(7-11-20)23-21(25)12-14-28-19-8-4-17(22)5-9-19/h4-11,16H,2-3,12-15H2,1H3,(H,23,25)