2-[[2,5-bis(iodanyl)phenyl]carbonylcarbamothioylamino]-5-chloranyl-benzoic acid

Systemtic Name: 2-[[2,5-bis(iodanyl)phenyl]carbonylcarbamothioylamino]-5-chloranyl-benzoic acid Openeye Name: 5-chloro-2-[(2,5-diiodobenzoyl)carbamothioylamino]benzoic acid CAS Name: 5-chloro-2-[[[[(2,5-diiodophenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]benzoic acid IUPAC Name: 5-chloro-2-[(2,5-diiodobenzoyl)carbamothioylamino]benzoic acid Traditional Name: 5-chloro-2-[(2,5-diiodobenzoyl)thiocarbamoylamino]benzoic acid Formula: C15H9ClI2N2O3S MolecularWeight: 586.5705

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)C(=O)O)NC(=S)NC(=O)C2=C(C=CC(=C2)I)I

Isomeric SMILES

C1=CC(=C(C=C1Cl)C(=O)O)NC(=S)NC(=O)C2=C(C=CC(=C2)I)I

InChI

InChI=1S/C15H9ClI2N2O3S/c16-7-1-4-12(10(5-7)14(22)23)19-15(24)20-13(21)9-6-8(17)2-3-11(9)18/h1-6H,(H,22,23)(H2,19,20,21,24)