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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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