2-bromanyl-N-[[(3-bromanyl-4-methoxy-phenyl)carbonylamino]carbamothioyl]benzamide

Systemtic Name: 2-bromanyl-N-[[(3-bromanyl-4-methoxy-phenyl)carbonylamino]carbamothioyl]benzamide Openeye Name: 2-bromo-N-[[(3-bromo-4-methoxy-benzoyl)amino]carbamothioyl]benzamide CAS Name: 2-bromo-N-[[[(3-bromo-4-methoxyphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 2-bromo-N-[[(3-bromo-4-methoxybenzoyl)amino]carbamothioyl]benzamide Traditional Name: 2-bromo-N-[[(3-bromo-4-methoxy-benzoyl)amino]thiocarbamoyl]benzamide Formula: C16H13Br2N3O3S MolecularWeight: 487.16572

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NNC(=S)NC(=O)C2=CC=CC=C2Br)Br

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NNC(=S)NC(=O)C2=CC=CC=C2Br)Br

InChI

InChI=1S/C16H13Br2N3O3S/c1-24-13-7-6-9(8-12(13)18)14(22)20-21-16(25)19-15(23)10-4-2-3-5-11(10)17/h2-8H,1H3,(H,20,22)(H2,19,21,23,25)