2-(2-bromanyl-4-ethyl-phenoxy)-N-[[(3-iodanyl-4-methoxy-phenyl)carbonylamino]carbamothioyl]ethanamide

Systemtic Name: 2-(2-bromanyl-4-ethyl-phenoxy)-N-[[(3-iodanyl-4-methoxy-phenyl)carbonylamino]carbamothioyl]ethanamide Openeye Name: 2-(2-bromo-4-ethyl-phenoxy)-N-[[(3-iodo-4-methoxy-benzoyl)amino]carbamothioyl]acetamide CAS Name: 2-(2-bromo-4-ethylphenoxy)-N-[[[(3-iodo-4-methoxyphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(2-bromo-4-ethylphenoxy)-N-[[(3-iodo-4-methoxybenzoyl)amino]carbamothioyl]acetamide Traditional Name: 2-(2-bromo-4-ethyl-phenoxy)-N-[[(3-iodo-4-methoxy-benzoyl)amino]thiocarbamoyl]acetamide Formula: C19H19BrIN3O4S MolecularWeight: 592.24533

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)OCC(=O)NC(=S)NNC(=O)C2=CC(=C(C=C2)OC)I)Br

Isomeric SMILES

CCC1=CC(=C(C=C1)OCC(=O)NC(=S)NNC(=O)C2=CC(=C(C=C2)OC)I)Br

InChI

InChI=1S/C19H19BrIN3O4S/c1-3-11-4-6-15(13(20)8-11)28-10-17(25)22-19(29)24-23-18(26)12-5-7-16(27-2)14(21)9-12/h4-9H,3,10H2,1-2H3,(H,23,26)(H2,22,24,25,29)