ethyl 4-(4-chlorophenyl)-2-[(3-fluorophenyl)carbonylamino]-5-methyl-thiophene-3-carboxylate

Systemtic Name: ethyl 4-(4-chlorophenyl)-2-[(3-fluorophenyl)carbonylamino]-5-methyl-thiophene-3-carboxylate Openeye Name: ethyl 4-(4-chlorophenyl)-2-[(3-fluorobenzoyl)amino]-5-methyl-thiophene-3-carboxylate CAS Name: 4-(4-chlorophenyl)-2-[[(3-fluorophenyl)-oxomethyl]amino]-5-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-chlorophenyl)-2-[(3-fluorobenzoyl)amino]-5-methylthiophene-3-carboxylate Traditional Name: 4-(4-chlorophenyl)-2-[(3-fluorobenzoyl)amino]-5-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C21H17ClFNO3S MolecularWeight: 417.880983

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C2=CC=C(C=C2)Cl)C)NC(=O)C3=CC(=CC=C3)F

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C2=CC=C(C=C2)Cl)C)NC(=O)C3=CC(=CC=C3)F

InChI

InChI=1S/C21H17ClFNO3S/c1-3-27-21(26)18-17(13-7-9-15(22)10-8-13)12(2)28-20(18)24-19(25)14-5-4-6-16(23)11-14/h4-11H,3H2,1-2H3,(H,24,25)