5-bromanyl-2-methoxy-N-[(4-methoxy-2-nitro-phenyl)carbamothioyl]benzamide

Systemtic Name: 5-bromanyl-2-methoxy-N-[(4-methoxy-2-nitro-phenyl)carbamothioyl]benzamide Openeye Name: 5-bromo-2-methoxy-N-[(4-methoxy-2-nitro-phenyl)carbamothioyl]benzamide CAS Name: 5-bromo-2-methoxy-N-[(4-methoxy-2-nitroanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 5-bromo-2-methoxy-N-[(4-methoxy-2-nitrophenyl)carbamothioyl]benzamide Traditional Name: 5-bromo-2-methoxy-N-[(4-methoxy-2-nitro-phenyl)thiocarbamoyl]benzamide Formula: C16H14BrN3O5S MolecularWeight: 440.26846

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14BrN3O5S/c1-24-10-4-5-12(13(8-10)20(22)23)18-16(26)19-15(21)11-7-9(17)3-6-14(11)25-2/h3-8H,1-2H3,(H2,18,19,21,26)