ethyl 2-[(5-bromanyl-2-chloranyl-phenyl)carbonylamino]-5-ethanoyl-4-methyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[(5-bromanyl-2-chloranyl-phenyl)carbonylamino]-5-ethanoyl-4-methyl-thiophene-3-carboxylate Openeye Name: ethyl 5-acetyl-2-[(5-bromo-2-chloro-benzoyl)amino]-4-methyl-thiophene-3-carboxylate CAS Name: 5-acetyl-2-[[(5-bromo-2-chlorophenyl)-oxomethyl]amino]-4-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-acetyl-2-[(5-bromo-2-chlorobenzoyl)amino]-4-methylthiophene-3-carboxylate Traditional Name: 5-acetyl-2-[(5-bromo-2-chloro-benzoyl)amino]-4-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C17H15BrClNO4S MolecularWeight: 444.7273

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)C2=C(C=CC(=C2)Br)Cl

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)C2=C(C=CC(=C2)Br)Cl

InChI

InChI=1S/C17H15BrClNO4S/c1-4-24-17(23)13-8(2)14(9(3)21)25-16(13)20-15(22)11-7-10(18)5-6-12(11)19/h5-7H,4H2,1-3H3,(H,20,22)