ethyl 2-[2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanylethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanylethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanylacetyl]amino]thiophene-3-carboxylate CAS Name: 2-[[1-oxo-2-[[4-(trifluoromethyl)-2-pyrimidinyl]thio]ethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanylacetyl]amino]thiophene-3-carboxylate Traditional Name: 2-[[2-[[4-(trifluoromethyl)pyrimidin-2-yl]thio]acetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C14H12F3N3O3S2 MolecularWeight: 391.38859

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1)NC(=O)CSC2=NC=CC(=N2)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=C(SC=C1)NC(=O)CSC2=NC=CC(=N2)C(F)(F)F

InChI

InChI=1S/C14H12F3N3O3S2/c1-2-23-12(22)8-4-6-24-11(8)20-10(21)7-25-13-18-5-3-9(19-13)14(15,16)17/h3-6H,2,7H2,1H3,(H,20,21)