5-bromanyl-N-[[(3-iodanyl-4-methoxy-phenyl)carbonylamino]carbamothioyl]furan-2-carboxamide

Systemtic Name: 5-bromanyl-N-[[(3-iodanyl-4-methoxy-phenyl)carbonylamino]carbamothioyl]furan-2-carboxamide Openeye Name: 5-bromo-N-[[(3-iodo-4-methoxy-benzoyl)amino]carbamothioyl]furan-2-carboxamide CAS Name: 5-bromo-N-[[[(3-iodo-4-methoxyphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: 5-bromo-N-[[(3-iodo-4-methoxybenzoyl)amino]carbamothioyl]furan-2-carboxamide Traditional Name: 5-bromo-N-[[(3-iodo-4-methoxy-benzoyl)amino]thiocarbamoyl]-2-furamide Formula: C14H11BrIN3O4S MolecularWeight: 524.12831

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NNC(=S)NC(=O)C2=CC=C(O2)Br)I

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NNC(=S)NC(=O)C2=CC=C(O2)Br)I

InChI

InChI=1S/C14H11BrIN3O4S/c1-22-9-3-2-7(6-8(9)16)12(20)18-19-14(24)17-13(21)10-4-5-11(15)23-10/h2-6H,1H3,(H,18,20)(H2,17,19,21,24)