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

Systemtic Name: 2-[1-(2-methylphenyl)imidazol-2-yl]sulfanyl-1-[4-(phenylsulfonyl)piperazin-1-yl]ethanone Openeye Name: 1-[4-(benzenesulfonyl)piperazin-1-yl]-2-[1-(o-tolyl)imidazol-2-yl]sulfanyl-ethanone CAS Name: 1-[4-(benzenesulfonyl)-1-piperazinyl]-2-[[1-(2-methylphenyl)-2-imidazolyl]thio]ethanone IUPAC Name: 1-[4-(benzenesulfonyl)piperazin-1-yl]-2-[1-(2-methylphenyl)imidazol-2-yl]sulfanylethanone Traditional Name: 1-(4-besylpiperazino)-2-[[1-(o-tolyl)imidazol-2-yl]thio]ethanone Formula: C22H24N4O3S2 MolecularWeight: 456.58096

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24N4O3S2/c1-18-7-5-6-10-20(18)26-12-11-23-22(26)30-17-21(27)24-13-15-25(16-14-24)31(28,29)19-8-3-2-4-9-19/h2-12H,13-17H2,1H3