[(E)-1-phenylethylideneamino] 2-[4-thiophen-2-yl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylethanoate

Systemtic Name: [(E)-1-phenylethylideneamino] 2-[4-thiophen-2-yl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylethanoate Openeye Name: [(E)-1-phenylethylideneamino] 2-[4-(2-thienyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylacetate CAS Name: 2-[[4-thiophen-2-yl-6-(trifluoromethyl)-2-pyrimidinyl]thio]acetic acid [(E)-1-phenylethylideneamino] ester IUPAC Name: [(E)-1-phenylethylideneamino] 2-[4-thiophen-2-yl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylacetate Traditional Name: 2-[[4-(2-thienyl)-6-(trifluoromethyl)pyrimidin-2-yl]thio]acetic acid [(E)-1-phenylethylideneamino] ester Formula: C19H14F3N3O2S2 MolecularWeight: 437.45857

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NOC(=O)CSC1=NC(=CC(=N1)C(F)(F)F)C2=CC=CS2)C3=CC=CC=C3

Isomeric SMILES

C/C(=N\OC(=O)CSC1=NC(=CC(=N1)C(F)(F)F)C2=CC=CS2)/C3=CC=CC=C3

InChI

InChI=1S/C19H14F3N3O2S2/c1-12(13-6-3-2-4-7-13)25-27-17(26)11-29-18-23-14(15-8-5-9-28-15)10-16(24-18)19(20,21)22/h2-10H,11H2,1H3/b25-12+