2-methyl-1-[[4-(4-methylphenyl)-5-propan-2-ylsulfanyl-1,2,4-triazol-3-yl]methyl]benzimidazole

Systemtic Name: 2-methyl-1-[[4-(4-methylphenyl)-5-propan-2-ylsulfanyl-1,2,4-triazol-3-yl]methyl]benzimidazole Openeye Name: 1-[[5-isopropylsulfanyl-4-(p-tolyl)-1,2,4-triazol-3-yl]methyl]-2-methyl-benzimidazole CAS Name: 2-methyl-1-[[4-(4-methylphenyl)-5-(propan-2-ylthio)-1,2,4-triazol-3-yl]methyl]benzimidazole IUPAC Name: 2-methyl-1-[[4-(4-methylphenyl)-5-propan-2-ylsulfanyl-1,2,4-triazol-3-yl]methyl]benzimidazole Traditional Name: 1-[[5-(isopropylthio)-4-(p-tolyl)-1,2,4-triazol-3-yl]methyl]-2-methyl-benzimidazole Formula: C21H23N5S MolecularWeight: 377.50582

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NN=C2SC(C)C)CN3C(=NC4=CC=CC=C43)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NN=C2SC(C)C)CN3C(=NC4=CC=CC=C43)C

InChI

InChI=1S/C21H23N5S/c1-14(2)27-21-24-23-20(26(21)17-11-9-15(3)10-12-17)13-25-16(4)22-18-7-5-6-8-19(18)25/h5-12,14H,13H2,1-4H3