1-(3-methylphenyl)-3-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]benzimidazole-2-thione

Systemtic Name: 1-(3-methylphenyl)-3-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]benzimidazole-2-thione Openeye Name: 1-(m-tolyl)-3-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]benzimidazole-2-thione CAS Name: 1-(3-methylphenyl)-3-[[4-(2-pyrimidinyl)-1-piperazinyl]methyl]-2-benzimidazolethione IUPAC Name: 1-(3-methylphenyl)-3-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]benzimidazole-2-thione Traditional Name: 1-(m-tolyl)-3-[[4-(2-pyrimidyl)piperazino]methyl]benzimidazole-2-thione Formula: C23H24N6S MolecularWeight: 416.54186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C3=CC=CC=C3N(C2=S)CN4CCN(CC4)C5=NC=CC=N5

Isomeric SMILES

CC1=CC(=CC=C1)N2C3=CC=CC=C3N(C2=S)CN4CCN(CC4)C5=NC=CC=N5

InChI

InChI=1S/C23H24N6S/c1-18-6-4-7-19(16-18)29-21-9-3-2-8-20(21)28(23(29)30)17-26-12-14-27(15-13-26)22-24-10-5-11-25-22/h2-11,16H,12-15,17H2,1H3