2-[[3-(3-methylphenyl)-1H-1,2,4-triazol-5-yl]methylsulfanyl]-1H-benzimidazole

Systemtic Name: 2-[[3-(3-methylphenyl)-1H-1,2,4-triazol-5-yl]methylsulfanyl]-1H-benzimidazole Openeye Name: 2-[[3-(m-tolyl)-1H-1,2,4-triazol-5-yl]methylsulfanyl]-1H-benzimidazole CAS Name: 2-[[3-(3-methylphenyl)-1H-1,2,4-triazol-5-yl]methylthio]-1H-benzimidazole IUPAC Name: 2-[[3-(3-methylphenyl)-1H-1,2,4-triazol-5-yl]methylsulfanyl]-1H-benzimidazole Traditional Name: 2-[[3-(m-tolyl)-1H-1,2,4-triazol-5-yl]methylthio]-1H-benzimidazole Formula: C17H15N5S MolecularWeight: 321.3995

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NNC(=N2)CSC3=NC4=CC=CC=C4N3

Isomeric SMILES

CC1=CC=CC(=C1)C2=NNC(=N2)CSC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C17H15N5S/c1-11-5-4-6-12(9-11)16-20-15(21-22-16)10-23-17-18-13-7-2-3-8-14(13)19-17/h2-9H,10H2,1H3,(H,18,19)(H,20,21,22)