2-(4-ethylphenoxy)-N-[[(2-iodanylphenyl)carbonylamino]carbamothioyl]ethanamide

Systemtic Name: 2-(4-ethylphenoxy)-N-[[(2-iodanylphenyl)carbonylamino]carbamothioyl]ethanamide Openeye Name: 2-(4-ethylphenoxy)-N-[[(2-iodobenzoyl)amino]carbamothioyl]acetamide CAS Name: 2-(4-ethylphenoxy)-N-[[[(2-iodophenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(4-ethylphenoxy)-N-[[(2-iodobenzoyl)amino]carbamothioyl]acetamide Traditional Name: 2-(4-ethylphenoxy)-N-[[(2-iodobenzoyl)amino]thiocarbamoyl]acetamide Formula: C18H18IN3O3S MolecularWeight: 483.32329

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OCC(=O)NC(=S)NNC(=O)C2=CC=CC=C2I

Isomeric SMILES

CCC1=CC=C(C=C1)OCC(=O)NC(=S)NNC(=O)C2=CC=CC=C2I

InChI

InChI=1S/C18H18IN3O3S/c1-2-12-7-9-13(10-8-12)25-11-16(23)20-18(26)22-21-17(24)14-5-3-4-6-15(14)19/h3-10H,2,11H2,1H3,(H,21,24)(H2,20,22,23,26)