ethyl 3-iodanyl-4-[(4-oxidanylidene-1,3-thiazol-2-yl)amino]benzoate

Systemtic Name: ethyl 3-iodanyl-4-[(4-oxidanylidene-1,3-thiazol-2-yl)amino]benzoate Openeye Name: ethyl 3-iodo-4-[(4-oxothiazol-2-yl)amino]benzoate CAS Name: 3-iodo-4-[(4-oxo-2-thiazolyl)amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-iodo-4-[(4-oxo-1,3-thiazol-2-yl)amino]benzoate Traditional Name: 3-iodo-4-[(4-keto-2-thiazolin-2-yl)amino]benzoic acid ethyl ester Formula: C12H11IN2O3S MolecularWeight: 390.19681

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)NC2=NC(=O)CS2)I

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)NC2=NC(=O)CS2)I

InChI

InChI=1S/C12H11IN2O3S/c1-2-18-11(17)7-3-4-9(8(13)5-7)14-12-15-10(16)6-19-12/h3-5H,2,6H2,1H3,(H,14,15,16)