N-(1,3-dimethyl-6-nitro-2-oxidanylidene-benzimidazol-5-yl)-2-(4-fluorophenyl)sulfanyl-ethanamide

Systemtic Name: N-(1,3-dimethyl-6-nitro-2-oxidanylidene-benzimidazol-5-yl)-2-(4-fluorophenyl)sulfanyl-ethanamide Openeye Name: N-(1,3-dimethyl-6-nitro-2-oxo-benzimidazol-5-yl)-2-(4-fluorophenyl)sulfanyl-acetamide CAS Name: N-(1,3-dimethyl-6-nitro-2-oxo-5-benzimidazolyl)-2-[(4-fluorophenyl)thio]acetamide IUPAC Name: N-(1,3-dimethyl-6-nitro-2-oxobenzimidazol-5-yl)-2-(4-fluorophenyl)sulfanylacetamide Traditional Name: 2-[(4-fluorophenyl)thio]-N-(2-keto-1,3-dimethyl-6-nitro-benzimidazol-5-yl)acetamide Formula: C17H15FN4O4S MolecularWeight: 390.388803

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC(=C(C=C2N(C1=O)C)[N+](=O)[O-])NC(=O)CSC3=CC=C(C=C3)F

Isomeric SMILES

CN1C2=CC(=C(C=C2N(C1=O)C)[N+](=O)[O-])NC(=O)CSC3=CC=C(C=C3)F

InChI

InChI=1S/C17H15FN4O4S/c1-20-14-7-12(13(22(25)26)8-15(14)21(2)17(20)24)19-16(23)9-27-11-5-3-10(18)4-6-11/h3-8H,9H2,1-2H3,(H,19,23)