ethyl 2-[4-[5-methyl-4-(trifluoromethylsulfanyl)pyrazol-1-yl]pyrimidin-2-yl]sulfanylethanoate

Systemtic Name: ethyl 2-[4-[5-methyl-4-(trifluoromethylsulfanyl)pyrazol-1-yl]pyrimidin-2-yl]sulfanylethanoate Openeye Name: ethyl 2-[4-[5-methyl-4-(trifluoromethylsulfanyl)pyrazol-1-yl]pyrimidin-2-yl]sulfanylacetate CAS Name: 2-[[4-[5-methyl-4-(trifluoromethylthio)-1-pyrazolyl]-2-pyrimidinyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-[5-methyl-4-(trifluoromethylsulfanyl)pyrazol-1-yl]pyrimidin-2-yl]sulfanylacetate Traditional Name: 2-[[4-[5-methyl-4-(trifluoromethylthio)pyrazol-1-yl]pyrimidin-2-yl]thio]acetic acid ethyl ester Formula: C13H13F3N4O2S2 MolecularWeight: 378.39313

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NC=CC(=N1)N2C(=C(C=N2)SC(F)(F)F)C

Isomeric SMILES

CCOC(=O)CSC1=NC=CC(=N1)N2C(=C(C=N2)SC(F)(F)F)C

InChI

InChI=1S/C13H13F3N4O2S2/c1-3-22-11(21)7-23-12-17-5-4-10(19-12)20-8(2)9(6-18-20)24-13(14,15)16/h4-6H,3,7H2,1-2H3