ethyl 2-[2-(4-bromanyl-2-fluoranyl-phenoxy)ethanoylamino]-4-methyl-5-(methylcarbamoyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-(4-bromanyl-2-fluoranyl-phenoxy)ethanoylamino]-4-methyl-5-(methylcarbamoyl)thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(4-bromo-2-fluoro-phenoxy)acetyl]amino]-4-methyl-5-(methylcarbamoyl)thiophene-3-carboxylate CAS Name: 2-[[2-(4-bromo-2-fluorophenoxy)-1-oxoethyl]amino]-4-methyl-5-(methylcarbamoyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(4-bromo-2-fluorophenoxy)acetyl]amino]-4-methyl-5-(methylcarbamoyl)thiophene-3-carboxylate Traditional Name: 2-[[2-(4-bromo-2-fluoro-phenoxy)acetyl]amino]-4-methyl-5-(methylcarbamoyl)thiophene-3-carboxylic acid ethyl ester Formula: C18H18BrFN2O5S MolecularWeight: 473.313323

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)NC)NC(=O)COC2=C(C=C(C=C2)Br)F

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)NC)NC(=O)COC2=C(C=C(C=C2)Br)F

InChI

InChI=1S/C18H18BrFN2O5S/c1-4-26-18(25)14-9(2)15(16(24)21-3)28-17(14)22-13(23)8-27-12-6-5-10(19)7-11(12)20/h5-7H,4,8H2,1-3H3,(H,21,24)(H,22,23)