(2-acetamido-1,3-thiazol-4-yl)methyl 2-bromanyl-4-fluoranyl-benzoate

Systemtic Name: (2-acetamido-1,3-thiazol-4-yl)methyl 2-bromanyl-4-fluoranyl-benzoate Openeye Name: (2-acetamidothiazol-4-yl)methyl 2-bromo-4-fluoro-benzoate CAS Name: 2-bromo-4-fluorobenzoic acid (2-acetamido-4-thiazolyl)methyl ester IUPAC Name: (2-acetamido-1,3-thiazol-4-yl)methyl 2-bromo-4-fluorobenzoate Traditional Name: 2-bromo-4-fluoro-benzoic acid (2-acetamidothiazol-4-yl)methyl ester Formula: C13H10BrFN2O3S MolecularWeight: 373.197503

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC(=CS1)COC(=O)C2=C(C=C(C=C2)F)Br

Isomeric SMILES

CC(=O)NC1=NC(=CS1)COC(=O)C2=C(C=C(C=C2)F)Br

InChI

InChI=1S/C13H10BrFN2O3S/c1-7(18)16-13-17-9(6-21-13)5-20-12(19)10-3-2-8(15)4-11(10)14/h2-4,6H,5H2,1H3,(H,16,17,18)