5-(4-methoxyphenyl)-1-(4-methylsulfanylphenyl)-3-(trifluoromethyl)-1,2,4-triazole

Systemtic Name: 5-(4-methoxyphenyl)-1-(4-methylsulfanylphenyl)-3-(trifluoromethyl)-1,2,4-triazole Openeye Name: 5-(4-methoxyphenyl)-1-(4-methylsulfanylphenyl)-3-(trifluoromethyl)-1,2,4-triazole CAS Name: 5-(4-methoxyphenyl)-1-[4-(methylthio)phenyl]-3-(trifluoromethyl)-1,2,4-triazole IUPAC Name: 5-(4-methoxyphenyl)-1-(4-methylsulfanylphenyl)-3-(trifluoromethyl)-1,2,4-triazole Traditional Name: 5-(4-methoxyphenyl)-1-[4-(methylthio)phenyl]-3-(trifluoromethyl)-1,2,4-triazole Formula: C17H14F3N3OS MolecularWeight: 365.37277

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC(=NN2C3=CC=C(C=C3)SC)C(F)(F)F

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC(=NN2C3=CC=C(C=C3)SC)C(F)(F)F

InChI

InChI=1S/C17H14F3N3OS/c1-24-13-7-3-11(4-8-13)15-21-16(17(18,19)20)22-23(15)12-5-9-14(25-2)10-6-12/h3-10H,1-2H3