4-(4-chlorophenyl)-2-[(4-chlorophenyl)methylsulfanyl]-5-[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]pyrimidine

Systemtic Name: 4-(4-chlorophenyl)-2-[(4-chlorophenyl)methylsulfanyl]-5-[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]pyrimidine Openeye Name: 4-(4-chlorophenyl)-2-[(4-chlorophenyl)methylsulfanyl]-5-[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]pyrimidine CAS Name: 4-(4-chlorophenyl)-2-[(4-chlorophenyl)methylthio]-5-[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]thio]pyrimidine IUPAC Name: 4-(4-chlorophenyl)-2-[(4-chlorophenyl)methylsulfanyl]-5-[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]pyrimidine Traditional Name: 2-[(4-chlorobenzyl)thio]-4-(4-chlorophenyl)-5-[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]thio]pyrimidine Formula: C21H14Cl2F3N5S2 MolecularWeight: 528.40057

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SC2=CN=C(N=C2C3=CC=C(C=C3)Cl)SCC4=CC=C(C=C4)Cl)C(F)(F)F

Isomeric SMILES

CN1C(=NN=C1SC2=CN=C(N=C2C3=CC=C(C=C3)Cl)SCC4=CC=C(C=C4)Cl)C(F)(F)F

InChI

InChI=1S/C21H14Cl2F3N5S2/c1-31-18(21(24,25)26)29-30-20(31)33-16-10-27-19(32-11-12-2-6-14(22)7-3-12)28-17(16)13-4-8-15(23)9-5-13/h2-10H,11H2,1H3