4-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-3-nitro-N-(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)benzamide

Systemtic Name: 4-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-3-nitro-N-(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)benzamide Openeye Name: 4-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-3-nitro-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)benzamide CAS Name: 4-[(4-methyl-1,2,4-triazol-3-yl)thio]-3-nitro-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)benzamide IUPAC Name: 4-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-3-nitro-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)benzamide Traditional Name: N-(2-keto-1,3-dihydrobenzimidazol-5-yl)-4-[(4-methyl-1,2,4-triazol-3-yl)thio]-3-nitro-benzamide Formula: C17H13N7O4S MolecularWeight: 411.39462

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NN=C1SC2=C(C=C(C=C2)C(=O)NC3=CC4=C(C=C3)NC(=O)N4)[N+](=O)[O-]

Isomeric SMILES

CN1C=NN=C1SC2=C(C=C(C=C2)C(=O)NC3=CC4=C(C=C3)NC(=O)N4)[N+](=O)[O-]

InChI

InChI=1S/C17H13N7O4S/c1-23-8-18-22-17(23)29-14-5-2-9(6-13(14)24(27)28)15(25)19-10-3-4-11-12(7-10)21-16(26)20-11/h2-8H,1H3,(H,19,25)(H2,20,21,26)