2,4-bis(chloranyl)-N-[[(3-iodanyl-4-methoxy-phenyl)carbonylamino]carbamothioyl]benzamide

Systemtic Name: 2,4-bis(chloranyl)-N-[[(3-iodanyl-4-methoxy-phenyl)carbonylamino]carbamothioyl]benzamide Openeye Name: 2,4-dichloro-N-[[(3-iodo-4-methoxy-benzoyl)amino]carbamothioyl]benzamide CAS Name: 2,4-dichloro-N-[[[(3-iodo-4-methoxyphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 2,4-dichloro-N-[[(3-iodo-4-methoxybenzoyl)amino]carbamothioyl]benzamide Traditional Name: 2,4-dichloro-N-[[(3-iodo-4-methoxy-benzoyl)amino]thiocarbamoyl]benzamide Formula: C16H12Cl2IN3O3S MolecularWeight: 524.16025

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NNC(=S)NC(=O)C2=C(C=C(C=C2)Cl)Cl)I

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NNC(=S)NC(=O)C2=C(C=C(C=C2)Cl)Cl)I

InChI

InChI=1S/C16H12Cl2IN3O3S/c1-25-13-5-2-8(6-12(13)19)14(23)21-22-16(26)20-15(24)10-4-3-9(17)7-11(10)18/h2-7H,1H3,(H,21,23)(H2,20,22,24,26)