1-(3-methylphenyl)-3-[[4-(phenylsulfonyl)piperazin-1-yl]methyl]imidazole-2-thione

Systemtic Name: 1-(3-methylphenyl)-3-[[4-(phenylsulfonyl)piperazin-1-yl]methyl]imidazole-2-thione Openeye Name: 1-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-3-(m-tolyl)imidazole-2-thione CAS Name: 1-[[4-(benzenesulfonyl)-1-piperazinyl]methyl]-3-(3-methylphenyl)-2-imidazolethione IUPAC Name: 1-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-3-(3-methylphenyl)imidazole-2-thione Traditional Name: 1-[(4-besylpiperazino)methyl]-3-(m-tolyl)-4-imidazoline-2-thione Formula: C21H24N4O2S2 MolecularWeight: 428.57086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C=CN(C2=S)CN3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)N2C=CN(C2=S)CN3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H24N4O2S2/c1-18-6-5-7-19(16-18)25-15-12-23(21(25)28)17-22-10-13-24(14-11-22)29(26,27)20-8-3-2-4-9-20/h2-9,12,15-16H,10-11,13-14,17H2,1H3