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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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