2-[2,4-bis(bromanyl)phenoxy]-N-[[(2-iodanylphenyl)carbonylamino]carbamothioyl]ethanamide

Systemtic Name: 2-[2,4-bis(bromanyl)phenoxy]-N-[[(2-iodanylphenyl)carbonylamino]carbamothioyl]ethanamide Openeye Name: 2-(2,4-dibromophenoxy)-N-[[(2-iodobenzoyl)amino]carbamothioyl]acetamide CAS Name: 2-(2,4-dibromophenoxy)-N-[[[(2-iodophenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(2,4-dibromophenoxy)-N-[[(2-iodobenzoyl)amino]carbamothioyl]acetamide Traditional Name: 2-(2,4-dibromophenoxy)-N-[[(2-iodobenzoyl)amino]thiocarbamoyl]acetamide Formula: C16H12Br2IN3O3S MolecularWeight: 613.06225

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H12Br2IN3O3S/c17-9-5-6-13(11(18)7-9)25-8-14(23)20-16(26)22-21-15(24)10-3-1-2-4-12(10)19/h1-7H,8H2,(H,21,24)(H2,20,22,23,26)