N-[(4-fluoranyl-3-nitro-phenyl)carbamothioyl]-3,4-dimethoxy-benzamide

Systemtic Name: N-[(4-fluoranyl-3-nitro-phenyl)carbamothioyl]-3,4-dimethoxy-benzamide Openeye Name: N-[(4-fluoro-3-nitro-phenyl)carbamothioyl]-3,4-dimethoxy-benzamide CAS Name: N-[(4-fluoro-3-nitroanilino)-sulfanylidenemethyl]-3,4-dimethoxybenzamide IUPAC Name: N-[(4-fluoro-3-nitrophenyl)carbamothioyl]-3,4-dimethoxybenzamide Traditional Name: N-[(4-fluoro-3-nitro-phenyl)thiocarbamoyl]-3,4-dimethoxy-benzamide Formula: C16H14FN3O5S MolecularWeight: 379.362863

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC(=C(C=C2)F)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC(=C(C=C2)F)[N+](=O)[O-])OC

InChI

InChI=1S/C16H14FN3O5S/c1-24-13-6-3-9(7-14(13)25-2)15(21)19-16(26)18-10-4-5-11(17)12(8-10)20(22)23/h3-8H,1-2H3,(H2,18,19,21,26)