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

Systemtic Name: 3-bromanyl-N-[[(3-iodanyl-4-methoxy-phenyl)carbonylamino]carbamothioyl]-4-methyl-benzamide Openeye Name: 3-bromo-N-[[(3-iodo-4-methoxy-benzoyl)amino]carbamothioyl]-4-methyl-benzamide CAS Name: 3-bromo-N-[[[(3-iodo-4-methoxyphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-4-methylbenzamide IUPAC Name: 3-bromo-N-[[(3-iodo-4-methoxybenzoyl)amino]carbamothioyl]-4-methylbenzamide Traditional Name: 3-bromo-N-[[(3-iodo-4-methoxy-benzoyl)amino]thiocarbamoyl]-4-methyl-benzamide Formula: C17H15BrIN3O3S MolecularWeight: 548.19277

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)C2=CC(=C(C=C2)OC)I)Br

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)C2=CC(=C(C=C2)OC)I)Br

InChI

InChI=1S/C17H15BrIN3O3S/c1-9-3-4-10(7-12(9)18)15(23)20-17(26)22-21-16(24)11-5-6-14(25-2)13(19)8-11/h3-8H,1-2H3,(H,21,24)(H2,20,22,23,26)