2-(4-bromanylphenoxy)-N-[[(3-iodanyl-4-methoxy-phenyl)carbonylamino]carbamothioyl]ethanamide

Systemtic Name: 2-(4-bromanylphenoxy)-N-[[(3-iodanyl-4-methoxy-phenyl)carbonylamino]carbamothioyl]ethanamide Openeye Name: 2-(4-bromophenoxy)-N-[[(3-iodo-4-methoxy-benzoyl)amino]carbamothioyl]acetamide CAS Name: 2-(4-bromophenoxy)-N-[[[(3-iodo-4-methoxyphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(4-bromophenoxy)-N-[[(3-iodo-4-methoxybenzoyl)amino]carbamothioyl]acetamide Traditional Name: 2-(4-bromophenoxy)-N-[[(3-iodo-4-methoxy-benzoyl)amino]thiocarbamoyl]acetamide Formula: C17H15BrIN3O4S MolecularWeight: 564.19217

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NNC(=S)NC(=O)COC2=CC=C(C=C2)Br)I

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NNC(=S)NC(=O)COC2=CC=C(C=C2)Br)I

InChI

InChI=1S/C17H15BrIN3O4S/c1-25-14-7-2-10(8-13(14)19)16(24)21-22-17(27)20-15(23)9-26-12-5-3-11(18)4-6-12/h2-8H,9H2,1H3,(H,21,24)(H2,20,22,23,27)