4-ethyl-6-(2-methoxy-4-methyl-phenoxy)-2-[[4-(trifluoromethyl)phenyl]methylsulfanyl]pyrimidine

Systemtic Name: 4-ethyl-6-(2-methoxy-4-methyl-phenoxy)-2-[[4-(trifluoromethyl)phenyl]methylsulfanyl]pyrimidine Openeye Name: 4-ethyl-6-(2-methoxy-4-methyl-phenoxy)-2-[[4-(trifluoromethyl)phenyl]methylsulfanyl]pyrimidine CAS Name: 4-ethyl-6-(2-methoxy-4-methylphenoxy)-2-[[4-(trifluoromethyl)phenyl]methylthio]pyrimidine IUPAC Name: 4-ethyl-6-(2-methoxy-4-methylphenoxy)-2-[[4-(trifluoromethyl)phenyl]methylsulfanyl]pyrimidine Traditional Name: 4-ethyl-6-(2-methoxy-4-methyl-phenoxy)-2-[[4-(trifluoromethyl)benzyl]thio]pyrimidine Formula: C22H21F3N2O2S MolecularWeight: 434.47455

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=NC(=N1)SCC2=CC=C(C=C2)C(F)(F)F)OC3=C(C=C(C=C3)C)OC

Isomeric SMILES

CCC1=CC(=NC(=N1)SCC2=CC=C(C=C2)C(F)(F)F)OC3=C(C=C(C=C3)C)OC

InChI

InChI=1S/C22H21F3N2O2S/c1-4-17-12-20(29-18-10-5-14(2)11-19(18)28-3)27-21(26-17)30-13-15-6-8-16(9-7-15)22(23,24)25/h5-12H,4,13H2,1-3H3