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

Systemtic Name: 1-[4-(3-methylphenyl)piperazin-1-yl]-2-[1-(2-propan-2-ylphenyl)imidazol-2-yl]sulfanyl-ethanone Openeye Name: 2-[1-(2-isopropylphenyl)imidazol-2-yl]sulfanyl-1-[4-(m-tolyl)piperazin-1-yl]ethanone CAS Name: 1-[4-(3-methylphenyl)-1-piperazinyl]-2-[[1-(2-propan-2-ylphenyl)-2-imidazolyl]thio]ethanone IUPAC Name: 1-[4-(3-methylphenyl)piperazin-1-yl]-2-[1-(2-propan-2-ylphenyl)imidazol-2-yl]sulfanylethanone Traditional Name: 1-[4-(m-tolyl)piperazino]-2-[(1-o-cumenylimidazol-2-yl)thio]ethanone Formula: C25H30N4OS MolecularWeight: 434.5969

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)C(=O)CSC3=NC=CN3C4=CC=CC=C4C(C)C

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)C(=O)CSC3=NC=CN3C4=CC=CC=C4C(C)C

InChI

InChI=1S/C25H30N4OS/c1-19(2)22-9-4-5-10-23(22)29-12-11-26-25(29)31-18-24(30)28-15-13-27(14-16-28)21-8-6-7-20(3)17-21/h4-12,17,19H,13-16,18H2,1-3H3