[2-(1,3-thiazol-2-ylcarbamoyl)pyridin-3-yl] 3-bromanyl-4-fluoranyl-benzoate

Systemtic Name: [2-(1,3-thiazol-2-ylcarbamoyl)pyridin-3-yl] 3-bromanyl-4-fluoranyl-benzoate Openeye Name: [2-(thiazol-2-ylcarbamoyl)-3-pyridyl] 3-bromo-4-fluoro-benzoate CAS Name: 3-bromo-4-fluorobenzoic acid [2-[oxo-(2-thiazolylamino)methyl]-3-pyridinyl] ester IUPAC Name: [2-(1,3-thiazol-2-ylcarbamoyl)pyridin-3-yl] 3-bromo-4-fluorobenzoate Traditional Name: 3-bromo-4-fluoro-benzoic acid [2-(thiazol-2-ylcarbamoyl)-3-pyridyl] ester Formula: C16H9BrFN3O3S MolecularWeight: 422.228363

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)C(=O)NC2=NC=CS2)OC(=O)C3=CC(=C(C=C3)F)Br

Isomeric SMILES

C1=CC(=C(N=C1)C(=O)NC2=NC=CS2)OC(=O)C3=CC(=C(C=C3)F)Br

InChI

InChI=1S/C16H9BrFN3O3S/c17-10-8-9(3-4-11(10)18)15(23)24-12-2-1-5-19-13(12)14(22)21-16-20-6-7-25-16/h1-8H,(H,20,21,22)