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

Systemtic Name: 6-methoxy-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)methylsulfanyl]-1H-benzimidazole Openeye Name: 6-methoxy-2-[(1-phenyltetrazol-5-yl)methylsulfanyl]-1H-benzimidazole CAS Name: 6-methoxy-2-[(1-phenyl-5-tetrazolyl)methylthio]-1H-benzimidazole IUPAC Name: 6-methoxy-2-[(1-phenyltetrazol-5-yl)methylsulfanyl]-1H-benzimidazole Traditional Name: 6-methoxy-2-[(1-phenyltetrazol-5-yl)methylthio]-1H-benzimidazole Formula: C16H14N6OS MolecularWeight: 338.38696

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(N2)SCC3=NN=NN3C4=CC=CC=C4

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(N2)SCC3=NN=NN3C4=CC=CC=C4

InChI

InChI=1S/C16H14N6OS/c1-23-12-7-8-13-14(9-12)18-16(17-13)24-10-15-19-20-21-22(15)11-5-3-2-4-6-11/h2-9H,10H2,1H3,(H,17,18)