N-[[(3-iodanyl-4-methoxy-phenyl)carbonylamino]carbamothioyl]-3-(2-phenoxyethoxy)benzamide

Systemtic Name: N-[[(3-iodanyl-4-methoxy-phenyl)carbonylamino]carbamothioyl]-3-(2-phenoxyethoxy)benzamide Openeye Name: N-[[(3-iodo-4-methoxy-benzoyl)amino]carbamothioyl]-3-(2-phenoxyethoxy)benzamide CAS Name: N-[[[(3-iodo-4-methoxyphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-3-(2-phenoxyethoxy)benzamide IUPAC Name: N-[[(3-iodo-4-methoxybenzoyl)amino]carbamothioyl]-3-(2-phenoxyethoxy)benzamide Traditional Name: N-[[(3-iodo-4-methoxy-benzoyl)amino]thiocarbamoyl]-3-(2-phenoxyethoxy)benzamide Formula: C24H22IN3O5S MolecularWeight: 591.41805

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NNC(=S)NC(=O)C2=CC(=CC=C2)OCCOC3=CC=CC=C3)I

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NNC(=S)NC(=O)C2=CC(=CC=C2)OCCOC3=CC=CC=C3)I

InChI

InChI=1S/C24H22IN3O5S/c1-31-21-11-10-17(15-20(21)25)23(30)27-28-24(34)26-22(29)16-6-5-9-19(14-16)33-13-12-32-18-7-3-2-4-8-18/h2-11,14-15H,12-13H2,1H3,(H,27,30)(H2,26,28,29,34)