5-iodanyl-2-[2,2,2-tris(chloranyl)ethanoylcarbamothioylamino]benzoic acid

Systemtic Name: 5-iodanyl-2-[2,2,2-tris(chloranyl)ethanoylcarbamothioylamino]benzoic acid Openeye Name: 5-iodo-2-[(2,2,2-trichloroacetyl)carbamothioylamino]benzoic acid CAS Name: 5-iodo-2-[[sulfanylidene-[(2,2,2-trichloro-1-oxoethyl)amino]methyl]amino]benzoic acid IUPAC Name: 5-iodo-2-[(2,2,2-trichloroacetyl)carbamothioylamino]benzoic acid Traditional Name: 5-iodo-2-[(2,2,2-trichloroacetyl)thiocarbamoylamino]benzoic acid Formula: C10H6Cl3IN2O3S MolecularWeight: 467.49471

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1I)C(=O)O)NC(=S)NC(=O)C(Cl)(Cl)Cl

Isomeric SMILES

C1=CC(=C(C=C1I)C(=O)O)NC(=S)NC(=O)C(Cl)(Cl)Cl

InChI

InChI=1S/C10H6Cl3IN2O3S/c11-10(12,13)8(19)16-9(20)15-6-2-1-4(14)3-5(6)7(17)18/h1-3H,(H,17,18)(H2,15,16,19,20)