N-[(4-bromanyl-2-fluoranyl-phenyl)carbamothioyl]-3,4-dimethoxy-benzamide

Systemtic Name: N-[(4-bromanyl-2-fluoranyl-phenyl)carbamothioyl]-3,4-dimethoxy-benzamide Openeye Name: N-[(4-bromo-2-fluoro-phenyl)carbamothioyl]-3,4-dimethoxy-benzamide CAS Name: N-[(4-bromo-2-fluoroanilino)-sulfanylidenemethyl]-3,4-dimethoxybenzamide IUPAC Name: N-[(4-bromo-2-fluorophenyl)carbamothioyl]-3,4-dimethoxybenzamide Traditional Name: N-[(4-bromo-2-fluoro-phenyl)thiocarbamoyl]-3,4-dimethoxy-benzamide Formula: C16H14BrFN2O3S MolecularWeight: 413.261363

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=C(C=C(C=C2)Br)F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=C(C=C(C=C2)Br)F)OC

InChI

InChI=1S/C16H14BrFN2O3S/c1-22-13-6-3-9(7-14(13)23-2)15(21)20-16(24)19-12-5-4-10(17)8-11(12)18/h3-8H,1-2H3,(H2,19,20,21,24)