ethyl 3-bromanyl-4-[(2-oxidanylidene-1,3-thiazolidin-4-yl)carbonylamino]benzoate

Systemtic Name: ethyl 3-bromanyl-4-[(2-oxidanylidene-1,3-thiazolidin-4-yl)carbonylamino]benzoate Openeye Name: ethyl 3-bromo-4-[(2-oxothiazolidine-4-carbonyl)amino]benzoate CAS Name: 3-bromo-4-[[oxo-(2-oxo-4-thiazolidinyl)methyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-bromo-4-[(2-oxo-1,3-thiazolidine-4-carbonyl)amino]benzoate Traditional Name: 3-bromo-4-[(2-ketothiazolidine-4-carbonyl)amino]benzoic acid ethyl ester Formula: C13H13BrN2O4S MolecularWeight: 373.22232

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)NC(=O)C2CSC(=O)N2)Br

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)NC(=O)C2CSC(=O)N2)Br

InChI

InChI=1S/C13H13BrN2O4S/c1-2-20-12(18)7-3-4-9(8(14)5-7)15-11(17)10-6-21-13(19)16-10/h3-5,10H,2,6H2,1H3,(H,15,17)(H,16,19)