5-(diiodosylamino)-2-[(4,5-dimethyl-1,3-thiazol-2-yl)diazenyl]benzoic acid

Systemtic Name: 5-(diiodosylamino)-2-[(4,5-dimethyl-1,3-thiazol-2-yl)diazenyl]benzoic acid Openeye Name: 5-(diiodosylamino)-2-(4,5-dimethylthiazol-2-yl)azo-benzoic acid CAS Name: 5-(diiodosylamino)-2-[(4,5-dimethyl-2-thiazolyl)azo]benzoic acid IUPAC Name: 5-(diiodosylamino)-2-[(4,5-dimethyl-1,3-thiazol-2-yl)diazenyl]benzoic acid Traditional Name: 5-(diiodosylamino)-2-(4,5-dimethylthiazol-2-yl)azo-benzoic acid Formula: C12H10I2N4O4S MolecularWeight: 560.10614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)N=NC2=C(C=C(C=C2)N(I=O)I=O)C(=O)O)C

Isomeric SMILES

CC1=C(SC(=N1)N=NC2=C(C=C(C=C2)N(I=O)I=O)C(=O)O)C

InChI

InChI=1S/C12H10I2N4O4S/c1-6-7(2)23-12(15-6)17-16-10-4-3-8(18(13-21)14-22)5-9(10)11(19)20/h3-5H,1-2H3,(H,19,20)