2-[4-(3-methoxyphenyl)piperazin-1-yl]-N-[2-(4-methylphenyl)sulfanylethyl]ethanamide

Systemtic Name: 2-[4-(3-methoxyphenyl)piperazin-1-yl]-N-[2-(4-methylphenyl)sulfanylethyl]ethanamide Openeye Name: 2-[4-(3-methoxyphenyl)piperazin-1-yl]-N-[2-(p-tolylsulfanyl)ethyl]acetamide CAS Name: 2-[4-(3-methoxyphenyl)-1-piperazinyl]-N-[2-[(4-methylphenyl)thio]ethyl]acetamide IUPAC Name: 2-[4-(3-methoxyphenyl)piperazin-1-yl]-N-[2-(4-methylphenyl)sulfanylethyl]acetamide Traditional Name: 2-[4-(3-methoxyphenyl)piperazino]-N-[2-(p-tolylthio)ethyl]acetamide Formula: C22H29N3O2S MolecularWeight: 399.54956

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCNC(=O)CN2CCN(CC2)C3=CC(=CC=C3)OC

Isomeric SMILES

CC1=CC=C(C=C1)SCCNC(=O)CN2CCN(CC2)C3=CC(=CC=C3)OC

InChI

InChI=1S/C22H29N3O2S/c1-18-6-8-21(9-7-18)28-15-10-23-22(26)17-24-11-13-25(14-12-24)19-4-3-5-20(16-19)27-2/h3-9,16H,10-15,17H2,1-2H3,(H,23,26)