ethyl 2-[[3-phenyl-6-(trifluoromethyl)-1,2,4-triazin-5-yl]sulfanyl]ethanoate

Systemtic Name: ethyl 2-[[3-phenyl-6-(trifluoromethyl)-1,2,4-triazin-5-yl]sulfanyl]ethanoate Openeye Name: ethyl 2-[[3-phenyl-6-(trifluoromethyl)-1,2,4-triazin-5-yl]sulfanyl]acetate CAS Name: 2-[[3-phenyl-6-(trifluoromethyl)-1,2,4-triazin-5-yl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[[3-phenyl-6-(trifluoromethyl)-1,2,4-triazin-5-yl]sulfanyl]acetate Traditional Name: 2-[[3-phenyl-6-(trifluoromethyl)-1,2,4-triazin-5-yl]thio]acetic acid ethyl ester Formula: C14H12F3N3O2S MolecularWeight: 343.32419

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=C(N=NC(=N1)C2=CC=CC=C2)C(F)(F)F

Isomeric SMILES

CCOC(=O)CSC1=C(N=NC(=N1)C2=CC=CC=C2)C(F)(F)F

InChI

InChI=1S/C14H12F3N3O2S/c1-2-22-10(21)8-23-13-11(14(15,16)17)19-20-12(18-13)9-6-4-3-5-7-9/h3-7H,2,8H2,1H3