2-[3-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]propylsulfanyl]-1H-benzimidazole

Systemtic Name: 2-[3-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]propylsulfanyl]-1H-benzimidazole Openeye Name: 2-[3-(1-methyltetrazol-5-yl)sulfanylpropylsulfanyl]-1H-benzimidazole CAS Name: 2-[3-[(1-methyl-5-tetrazolyl)thio]propylthio]-1H-benzimidazole IUPAC Name: 2-[3-(1-methyltetrazol-5-yl)sulfanylpropylsulfanyl]-1H-benzimidazole Traditional Name: 2-[3-[(1-methyltetrazol-5-yl)thio]propylthio]-1H-benzimidazole Formula: C12H14N6S2 MolecularWeight: 306.40976

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=N1)SCCCSC2=NC3=CC=CC=C3N2

Isomeric SMILES

CN1C(=NN=N1)SCCCSC2=NC3=CC=CC=C3N2

InChI

InChI=1S/C12H14N6S2/c1-18-12(15-16-17-18)20-8-4-7-19-11-13-9-5-2-3-6-10(9)14-11/h2-3,5-6H,4,7-8H2,1H3,(H,13,14)