6-nitro-2-(1H-1,2,4-triazol-5-ylsulfanylmethyl)-1H-benzimidazole

Systemtic Name: 6-nitro-2-(1H-1,2,4-triazol-5-ylsulfanylmethyl)-1H-benzimidazole Openeye Name: 6-nitro-2-(1H-1,2,4-triazol-5-ylsulfanylmethyl)-1H-benzimidazole CAS Name: 6-nitro-2-[(1H-1,2,4-triazol-5-ylthio)methyl]-1H-benzimidazole IUPAC Name: 6-nitro-2-(1H-1,2,4-triazol-5-ylsulfanylmethyl)-1H-benzimidazole Traditional Name: 6-nitro-2-[(1H-1,2,4-triazol-5-ylthio)methyl]-1H-benzimidazole Formula: C10H8N6O2S MolecularWeight: 276.27452

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1[N+](=O)[O-])NC(=N2)CSC3=NC=NN3

Isomeric SMILES

C1=CC2=C(C=C1[N+](=O)[O-])NC(=N2)CSC3=NC=NN3

InChI

InChI=1S/C10H8N6O2S/c17-16(18)6-1-2-7-8(3-6)14-9(13-7)4-19-10-11-5-12-15-10/h1-3,5H,4H2,(H,13,14)(H,11,12,15)