ethyl 4-cyano-3-methyl-5-[[3-(trifluoromethyl)phenyl]carbonylamino]thiophene-2-carboxylate

Systemtic Name: ethyl 4-cyano-3-methyl-5-[[3-(trifluoromethyl)phenyl]carbonylamino]thiophene-2-carboxylate Openeye Name: ethyl 4-cyano-3-methyl-5-[[3-(trifluoromethyl)benzoyl]amino]thiophene-2-carboxylate CAS Name: 4-cyano-3-methyl-5-[[oxo-[3-(trifluoromethyl)phenyl]methyl]amino]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-cyano-3-methyl-5-[[3-(trifluoromethyl)benzoyl]amino]thiophene-2-carboxylate Traditional Name: 4-cyano-3-methyl-5-[[3-(trifluoromethyl)benzoyl]amino]thiophene-2-carboxylic acid ethyl ester Formula: C17H13F3N2O3S MolecularWeight: 382.35693

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)NC(=O)C2=CC(=CC=C2)C(F)(F)F)C#N)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)NC(=O)C2=CC(=CC=C2)C(F)(F)F)C#N)C

InChI

InChI=1S/C17H13F3N2O3S/c1-3-25-16(24)13-9(2)12(8-21)15(26-13)22-14(23)10-5-4-6-11(7-10)17(18,19)20/h4-7H,3H2,1-2H3,(H,22,23)