4-methyl-3-(4-pentylphenyl)-5-[2-(trifluoromethyl)phenyl]-1,2,4-triazole

Systemtic Name: 4-methyl-3-(4-pentylphenyl)-5-[2-(trifluoromethyl)phenyl]-1,2,4-triazole Openeye Name: 4-methyl-3-(4-pentylphenyl)-5-[2-(trifluoromethyl)phenyl]-1,2,4-triazole CAS Name: 4-methyl-3-(4-pentylphenyl)-5-[2-(trifluoromethyl)phenyl]-1,2,4-triazole IUPAC Name: 4-methyl-3-(4-pentylphenyl)-5-[2-(trifluoromethyl)phenyl]-1,2,4-triazole Traditional Name: 3-(4-amylphenyl)-4-methyl-5-[2-(trifluoromethyl)phenyl]-1,2,4-triazole Formula: C21H22F3N3 MolecularWeight: 373.41469

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C2=NN=C(N2C)C3=CC=CC=C3C(F)(F)F

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C2=NN=C(N2C)C3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C21H22F3N3/c1-3-4-5-8-15-11-13-16(14-12-15)19-25-26-20(27(19)2)17-9-6-7-10-18(17)21(22,23)24/h6-7,9-14H,3-5,8H2,1-2H3