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

Systemtic Name: ethyl 2-[(2-chloranyl-4-fluoranyl-phenyl)carbonylamino]-4-(4-ethoxyphenyl)-5-methyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[(2-chloro-4-fluoro-benzoyl)amino]-4-(4-ethoxyphenyl)-5-methyl-thiophene-3-carboxylate CAS Name: 2-[[(2-chloro-4-fluorophenyl)-oxomethyl]amino]-4-(4-ethoxyphenyl)-5-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(2-chloro-4-fluorobenzoyl)amino]-4-(4-ethoxyphenyl)-5-methylthiophene-3-carboxylate Traditional Name: 2-[(2-chloro-4-fluoro-benzoyl)amino]-5-methyl-4-p-phenetyl-thiophene-3-carboxylic acid ethyl ester Formula: C23H21ClFNO4S MolecularWeight: 461.933543

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=C(SC(=C2C(=O)OCC)NC(=O)C3=C(C=C(C=C3)F)Cl)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=C(SC(=C2C(=O)OCC)NC(=O)C3=C(C=C(C=C3)F)Cl)C

InChI

InChI=1S/C23H21ClFNO4S/c1-4-29-16-9-6-14(7-10-16)19-13(3)31-22(20(19)23(28)30-5-2)26-21(27)17-11-8-15(25)12-18(17)24/h6-12H,4-5H2,1-3H3,(H,26,27)