2-(1H-benzimidazol-2-ylsulfanyl)-N-(2-nitro-4-oxidanyl-phenyl)ethanamide

Systemtic Name: 2-(1H-benzimidazol-2-ylsulfanyl)-N-(2-nitro-4-oxidanyl-phenyl)ethanamide Openeye Name: 2-(1H-benzimidazol-2-ylsulfanyl)-N-(4-hydroxy-2-nitro-phenyl)acetamide CAS Name: 2-(1H-benzimidazol-2-ylthio)-N-(4-hydroxy-2-nitrophenyl)acetamide IUPAC Name: 2-(1H-benzimidazol-2-ylsulfanyl)-N-(4-hydroxy-2-nitrophenyl)acetamide Traditional Name: 2-(1H-benzimidazol-2-ylthio)-N-(4-hydroxy-2-nitro-phenyl)acetamide Formula: C15H12N4O4S MolecularWeight: 344.34518

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)SCC(=O)NC3=C(C=C(C=C3)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)SCC(=O)NC3=C(C=C(C=C3)O)[N+](=O)[O-]

InChI

InChI=1S/C15H12N4O4S/c20-9-5-6-12(13(7-9)19(22)23)16-14(21)8-24-15-17-10-3-1-2-4-11(10)18-15/h1-7,20H,8H2,(H,16,21)(H,17,18)