N-[4-[3-[4-(2-methylphenyl)piperazin-1-yl]propylsulfanyl]phenyl]ethanamide

Systemtic Name: N-[4-[3-[4-(2-methylphenyl)piperazin-1-yl]propylsulfanyl]phenyl]ethanamide Openeye Name: N-[4-[3-[4-(o-tolyl)piperazin-1-yl]propylsulfanyl]phenyl]acetamide CAS Name: N-[4-[3-[4-(2-methylphenyl)-1-piperazinyl]propylthio]phenyl]acetamide IUPAC Name: N-[4-[3-[4-(2-methylphenyl)piperazin-1-yl]propylsulfanyl]phenyl]acetamide Traditional Name: N-[4-[3-[4-(o-tolyl)piperazino]propylthio]phenyl]acetamide Formula: C22H29N3OS MolecularWeight: 383.55016

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CCN(CC2)CCCSC3=CC=C(C=C3)NC(=O)C

Isomeric SMILES

CC1=CC=CC=C1N2CCN(CC2)CCCSC3=CC=C(C=C3)NC(=O)C

InChI

InChI=1S/C22H29N3OS/c1-18-6-3-4-7-22(18)25-15-13-24(14-16-25)12-5-17-27-21-10-8-20(9-11-21)23-19(2)26/h3-4,6-11H,5,12-17H2,1-2H3,(H,23,26)