N-[(3-bromanyl-4-methoxy-phenyl)carbamothioyl]-2-(4-nitrophenoxy)ethanamide

Systemtic Name: N-[(3-bromanyl-4-methoxy-phenyl)carbamothioyl]-2-(4-nitrophenoxy)ethanamide Openeye Name: N-[(3-bromo-4-methoxy-phenyl)carbamothioyl]-2-(4-nitrophenoxy)acetamide CAS Name: N-[(3-bromo-4-methoxyanilino)-sulfanylidenemethyl]-2-(4-nitrophenoxy)acetamide IUPAC Name: N-[(3-bromo-4-methoxyphenyl)carbamothioyl]-2-(4-nitrophenoxy)acetamide Traditional Name: N-[(3-bromo-4-methoxy-phenyl)thiocarbamoyl]-2-(4-nitrophenoxy)acetamide Formula: C16H14BrN3O5S MolecularWeight: 440.26846

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=S)NC(=O)COC2=CC=C(C=C2)[N+](=O)[O-])Br

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=S)NC(=O)COC2=CC=C(C=C2)[N+](=O)[O-])Br

InChI

InChI=1S/C16H14BrN3O5S/c1-24-14-7-2-10(8-13(14)17)18-16(26)19-15(21)9-25-12-5-3-11(4-6-12)20(22)23/h2-8H,9H2,1H3,(H2,18,19,21,26)