4,5-dimethyl-6-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]-2-(trifluoromethyl)pyrimidine

Systemtic Name: 4,5-dimethyl-6-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]-2-(trifluoromethyl)pyrimidine Openeye Name: 4,5-dimethyl-6-[[5-(2-thienyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-2-(trifluoromethyl)pyrimidine CAS Name: 4,5-dimethyl-6-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)thio]-2-(trifluoromethyl)pyrimidine IUPAC Name: 4,5-dimethyl-6-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]-2-(trifluoromethyl)pyrimidine Traditional Name: 4,5-dimethyl-6-[[5-(2-thienyl)-1H-1,2,4-triazol-3-yl]thio]-2-(trifluoromethyl)pyrimidine Formula: C13H10F3N5S2 MolecularWeight: 357.37721

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N=C1SC2=NNC(=N2)C3=CC=CS3)C(F)(F)F)C

Isomeric SMILES

CC1=C(N=C(N=C1SC2=NNC(=N2)C3=CC=CS3)C(F)(F)F)C

InChI

InChI=1S/C13H10F3N5S2/c1-6-7(2)17-11(13(14,15)16)19-10(6)23-12-18-9(20-21-12)8-4-3-5-22-8/h3-5H,1-2H3,(H,18,20,21)