methyl 2-[2-(2-bromanyl-4-fluoranyl-phenoxy)ethanoylamino]-1,3-thiazole-5-carboxylate

Systemtic Name: methyl 2-[2-(2-bromanyl-4-fluoranyl-phenoxy)ethanoylamino]-1,3-thiazole-5-carboxylate Openeye Name: methyl 2-[[2-(2-bromo-4-fluoro-phenoxy)acetyl]amino]thiazole-5-carboxylate CAS Name: 2-[[2-(2-bromo-4-fluorophenoxy)-1-oxoethyl]amino]-5-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[[2-(2-bromo-4-fluorophenoxy)acetyl]amino]-1,3-thiazole-5-carboxylate Traditional Name: 2-[[2-(2-bromo-4-fluoro-phenoxy)acetyl]amino]thiazole-5-carboxylic acid methyl ester Formula: C13H10BrFN2O4S MolecularWeight: 389.196903

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN=C(S1)NC(=O)COC2=C(C=C(C=C2)F)Br

Isomeric SMILES

COC(=O)C1=CN=C(S1)NC(=O)COC2=C(C=C(C=C2)F)Br

InChI

InChI=1S/C13H10BrFN2O4S/c1-20-12(19)10-5-16-13(22-10)17-11(18)6-21-9-3-2-7(15)4-8(9)14/h2-5H,6H2,1H3,(H,16,17,18)