2-[[1-(2,4-dimethylphenyl)-1,2,3,4-tetrazol-5-yl]methylsulfanyl]-1H-benzimidazole

Systemtic Name: 2-[[1-(2,4-dimethylphenyl)-1,2,3,4-tetrazol-5-yl]methylsulfanyl]-1H-benzimidazole Openeye Name: 2-[[1-(2,4-dimethylphenyl)tetrazol-5-yl]methylsulfanyl]-1H-benzimidazole CAS Name: 2-[[1-(2,4-dimethylphenyl)-5-tetrazolyl]methylthio]-1H-benzimidazole IUPAC Name: 2-[[1-(2,4-dimethylphenyl)tetrazol-5-yl]methylsulfanyl]-1H-benzimidazole Traditional Name: 2-[[1-(2,4-dimethylphenyl)tetrazol-5-yl]methylthio]-1H-benzimidazole Formula: C17H16N6S MolecularWeight: 336.41414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C(=NN=N2)CSC3=NC4=CC=CC=C4N3)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C(=NN=N2)CSC3=NC4=CC=CC=C4N3)C

InChI

InChI=1S/C17H16N6S/c1-11-7-8-15(12(2)9-11)23-16(20-21-22-23)10-24-17-18-13-5-3-4-6-14(13)19-17/h3-9H,10H2,1-2H3,(H,18,19)