3-bromanyl-4-methoxy-N-[[(4-nitrophenyl)amino]carbamothioyl]benzamide

Systemtic Name: 3-bromanyl-4-methoxy-N-[[(4-nitrophenyl)amino]carbamothioyl]benzamide Openeye Name: 3-bromo-4-methoxy-N-[(4-nitroanilino)carbamothioyl]benzamide CAS Name: 3-bromo-4-methoxy-N-[[(4-nitrophenyl)hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-4-methoxy-N-[(4-nitroanilino)carbamothioyl]benzamide Traditional Name: 3-bromo-4-methoxy-N-[(4-nitroanilino)thiocarbamoyl]benzamide Formula: C15H13BrN4O4S MolecularWeight: 425.25712

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC(=S)NNC2=CC=C(C=C2)[N+](=O)[O-])Br

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC(=S)NNC2=CC=C(C=C2)[N+](=O)[O-])Br

InChI

InChI=1S/C15H13BrN4O4S/c1-24-13-7-2-9(8-12(13)16)14(21)17-15(25)19-18-10-3-5-11(6-4-10)20(22)23/h2-8,18H,1H3,(H2,17,19,21,25)