methyl 2-[2-(2-bromanyl-5-fluoranyl-phenyl)carbonyloxyethanoylamino]-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[2-(2-bromanyl-5-fluoranyl-phenyl)carbonyloxyethanoylamino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: methyl 2-[[2-(2-bromo-5-fluoro-benzoyl)oxyacetyl]amino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[2-[(2-bromo-5-fluorophenyl)-oxomethoxy]-1-oxoethyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[2-(2-bromo-5-fluorobenzoyl)oxyacetyl]amino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-[[2-(2-bromo-5-fluoro-benzoyl)oxyacetyl]amino]-4,5-dimethyl-thiophene-3-carboxylic acid methyl ester Formula: C17H15BrFNO5S MolecularWeight: 444.272103

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)COC(=O)C2=C(C=CC(=C2)F)Br)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)COC(=O)C2=C(C=CC(=C2)F)Br)C

InChI

InChI=1S/C17H15BrFNO5S/c1-8-9(2)26-15(14(8)17(23)24-3)20-13(21)7-25-16(22)11-6-10(19)4-5-12(11)18/h4-6H,7H2,1-3H3,(H,20,21)