[3-methyl-2-[(4-methylphenyl)methylsulfanyl]benzimidazol-5-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone

Systemtic Name: [3-methyl-2-[(4-methylphenyl)methylsulfanyl]benzimidazol-5-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Openeye Name: [3-methyl-2-(p-tolylmethylsulfanyl)benzimidazol-5-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone CAS Name: [3-methyl-2-[(4-methylphenyl)methylthio]-5-benzimidazolyl]-[4-(2-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: [3-methyl-2-[(4-methylphenyl)methylsulfanyl]benzimidazol-5-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Traditional Name: [3-methyl-2-[(4-methylbenzyl)thio]benzimidazol-5-yl]-[4-(2-pyrimidyl)piperazino]methanone Formula: C25H26N6OS MolecularWeight: 458.57854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NC3=C(N2C)C=C(C=C3)C(=O)N4CCN(CC4)C5=NC=CC=N5

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NC3=C(N2C)C=C(C=C3)C(=O)N4CCN(CC4)C5=NC=CC=N5

InChI

InChI=1S/C25H26N6OS/c1-18-4-6-19(7-5-18)17-33-25-28-21-9-8-20(16-22(21)29(25)2)23(32)30-12-14-31(15-13-30)24-26-10-3-11-27-24/h3-11,16H,12-15,17H2,1-2H3