ethyl (2S)-2-[4-thiophen-2-yl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylpropanoate

Systemtic Name: ethyl (2S)-2-[4-thiophen-2-yl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylpropanoate Openeye Name: ethyl (2S)-2-[4-(2-thienyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylpropanoate CAS Name: (2S)-2-[[4-thiophen-2-yl-6-(trifluoromethyl)-2-pyrimidinyl]thio]propanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-[4-thiophen-2-yl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylpropanoate Traditional Name: (2S)-2-[[4-(2-thienyl)-6-(trifluoromethyl)pyrimidin-2-yl]thio]propionic acid ethyl ester Formula: C14H13F3N2O2S2 MolecularWeight: 362.39043

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)SC1=NC(=CC(=N1)C(F)(F)F)C2=CC=CS2

Isomeric SMILES

CCOC(=O)[C@H](C)SC1=NC(=CC(=N1)C(F)(F)F)C2=CC=CS2

InChI

InChI=1S/C14H13F3N2O2S2/c1-3-21-12(20)8(2)23-13-18-9(10-5-4-6-22-10)7-11(19-13)14(15,16)17/h4-8H,3H2,1-2H3/t8-/m0/s1