2-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]-5-methyl-4-(4-propan-2-ylphenyl)-1,2,4-triazol-3-one

Systemtic Name: 2-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]-5-methyl-4-(4-propan-2-ylphenyl)-1,2,4-triazol-3-one Openeye Name: 2-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-4-(4-isopropylphenyl)-5-methyl-1,2,4-triazol-3-one CAS Name: 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-5-methyl-4-(4-propan-2-ylphenyl)-1,2,4-triazol-3-one IUPAC Name: 2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-5-methyl-4-(4-propan-2-ylphenyl)-1,2,4-triazol-3-one Traditional Name: 2-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-5-methyl-4-p-cumenyl-1,2,4-triazol-3-one Formula: C18H16ClF3N4O MolecularWeight: 396.79405

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)N1C2=CC=C(C=C2)C(C)C)C3=C(C=C(C=N3)C(F)(F)F)Cl

Isomeric SMILES

CC1=NN(C(=O)N1C2=CC=C(C=C2)C(C)C)C3=C(C=C(C=N3)C(F)(F)F)Cl

InChI

InChI=1S/C18H16ClF3N4O/c1-10(2)12-4-6-14(7-5-12)25-11(3)24-26(17(25)27)16-15(19)8-13(9-23-16)18(20,21)22/h4-10H,1-3H3