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

Systemtic Name: 3-bromanyl-N-[[(3-iodanyl-4-methoxy-phenyl)carbonylamino]carbamothioyl]-4-methoxy-benzamide Openeye Name: 3-bromo-N-[[(3-iodo-4-methoxy-benzoyl)amino]carbamothioyl]-4-methoxy-benzamide CAS Name: 3-bromo-N-[[[(3-iodo-4-methoxyphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-4-methoxybenzamide IUPAC Name: 3-bromo-N-[[(3-iodo-4-methoxybenzoyl)amino]carbamothioyl]-4-methoxybenzamide Traditional Name: 3-bromo-N-[[(3-iodo-4-methoxy-benzoyl)amino]thiocarbamoyl]-4-methoxy-benzamide Formula: C17H15BrIN3O4S MolecularWeight: 564.19217

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15BrIN3O4S/c1-25-13-5-3-9(7-11(13)18)15(23)20-17(27)22-21-16(24)10-4-6-14(26-2)12(19)8-10/h3-8H,1-2H3,(H,21,24)(H2,20,22,23,27)