ethyl 5-aminocarbonyl-4-methyl-2-[[5-(trifluoromethyl)-1H-pyrazol-3-yl]carbonylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 5-aminocarbonyl-4-methyl-2-[[5-(trifluoromethyl)-1H-pyrazol-3-yl]carbonylamino]thiophene-3-carboxylate Openeye Name: ethyl 5-carbamoyl-4-methyl-2-[[5-(trifluoromethyl)-1H-pyrazole-3-carbonyl]amino]thiophene-3-carboxylate CAS Name: 5-carbamoyl-4-methyl-2-[[oxo-[5-(trifluoromethyl)-1H-pyrazol-3-yl]methyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-carbamoyl-4-methyl-2-[[5-(trifluoromethyl)-1H-pyrazole-3-carbonyl]amino]thiophene-3-carboxylate Traditional Name: 5-carbamoyl-4-methyl-2-[[5-(trifluoromethyl)-1H-pyrazole-3-carbonyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C14H13F3N4O4S MolecularWeight: 390.33763

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)N)NC(=O)C2=NNC(=C2)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)N)NC(=O)C2=NNC(=C2)C(F)(F)F

InChI

InChI=1S/C14H13F3N4O4S/c1-3-25-13(24)8-5(2)9(10(18)22)26-12(8)19-11(23)6-4-7(21-20-6)14(15,16)17/h4H,3H2,1-2H3,(H2,18,22)(H,19,23)(H,20,21)