2-(1H-benzimidazol-2-ylsulfanyl)-N-(2-methoxy-5-nitro-phenyl)ethanamide

Systemtic Name: 2-(1H-benzimidazol-2-ylsulfanyl)-N-(2-methoxy-5-nitro-phenyl)ethanamide Openeye Name: 2-(1H-benzimidazol-2-ylsulfanyl)-N-(2-methoxy-5-nitro-phenyl)acetamide CAS Name: 2-(1H-benzimidazol-2-ylthio)-N-(2-methoxy-5-nitrophenyl)acetamide IUPAC Name: 2-(1H-benzimidazol-2-ylsulfanyl)-N-(2-methoxy-5-nitrophenyl)acetamide Traditional Name: 2-(1H-benzimidazol-2-ylthio)-N-(2-methoxy-5-nitro-phenyl)acetamide Formula: C16H14N4O4S MolecularWeight: 358.37176

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)CSC2=NC3=CC=CC=C3N2

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)CSC2=NC3=CC=CC=C3N2

InChI

InChI=1S/C16H14N4O4S/c1-24-14-7-6-10(20(22)23)8-13(14)17-15(21)9-25-16-18-11-4-2-3-5-12(11)19-16/h2-8H,9H2,1H3,(H,17,21)(H,18,19)