1-[4-(3-chlorophenyl)piperazin-1-yl]-2-[1-(2-methylphenyl)imidazol-2-yl]sulfanyl-ethanone

Systemtic Name: 1-[4-(3-chlorophenyl)piperazin-1-yl]-2-[1-(2-methylphenyl)imidazol-2-yl]sulfanyl-ethanone Openeye Name: 1-[4-(3-chlorophenyl)piperazin-1-yl]-2-[1-(o-tolyl)imidazol-2-yl]sulfanyl-ethanone CAS Name: 1-[4-(3-chlorophenyl)-1-piperazinyl]-2-[[1-(2-methylphenyl)-2-imidazolyl]thio]ethanone IUPAC Name: 1-[4-(3-chlorophenyl)piperazin-1-yl]-2-[1-(2-methylphenyl)imidazol-2-yl]sulfanylethanone Traditional Name: 1-[4-(3-chlorophenyl)piperazino]-2-[[1-(o-tolyl)imidazol-2-yl]thio]ethanone Formula: C22H23ClN4OS MolecularWeight: 426.96222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C=CN=C2SCC(=O)N3CCN(CC3)C4=CC(=CC=C4)Cl

Isomeric SMILES

CC1=CC=CC=C1N2C=CN=C2SCC(=O)N3CCN(CC3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C22H23ClN4OS/c1-17-5-2-3-8-20(17)27-10-9-24-22(27)29-16-21(28)26-13-11-25(12-14-26)19-7-4-6-18(23)15-19/h2-10,15H,11-14,16H2,1H3