4-(1H-benzimidazol-2-ylsulfanylmethyl)-N-(1H-1,2,4-triazol-5-yl)benzenecarboximidate

Systemtic Name: 4-(1H-benzimidazol-2-ylsulfanylmethyl)-N-(1H-1,2,4-triazol-5-yl)benzenecarboximidate Openeye Name: 4-(1H-benzimidazol-2-ylsulfanylmethyl)-N-(1H-1,2,4-triazol-5-yl)benzenecarboximidate CAS Name: 4-[(1H-benzimidazol-2-ylthio)methyl]-N-(1H-1,2,4-triazol-5-yl)benzenecarboximidate IUPAC Name: 4-(1H-benzimidazol-2-ylsulfanylmethyl)-N-(1H-1,2,4-triazol-5-yl)benzenecarboximidate Traditional Name: 4-[(1H-benzimidazol-2-ylthio)methyl]-N-(1H-1,2,4-triazol-5-yl)benzenecarboximidate Formula: C17H13N6OS- MolecularWeight: 349.38972

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)SCC3=CC=C(C=C3)C(=NC4=NC=NN4)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)SCC3=CC=C(C=C3)C(=NC4=NC=NN4)[O-]

InChI

InChI=1S/C17H14N6OS/c24-15(22-16-18-10-19-23-16)12-7-5-11(6-8-12)9-25-17-20-13-3-1-2-4-14(13)21-17/h1-8,10H,9H2,(H,20,21)(H2,18,19,22,23,24)/p-1