[2-azanylidene-2-[5-methyl-1-[6-methyl-4-(trifluoromethyl)pyridin-2-yl]pyrazol-4-yl]ethyl] benzoate

Systemtic Name: [2-azanylidene-2-[5-methyl-1-[6-methyl-4-(trifluoromethyl)pyridin-2-yl]pyrazol-4-yl]ethyl] benzoate Openeye Name: [2-imino-2-[5-methyl-1-[6-methyl-4-(trifluoromethyl)-2-pyridyl]pyrazol-4-yl]ethyl] benzoate CAS Name: benzoic acid [2-imino-2-[5-methyl-1-[6-methyl-4-(trifluoromethyl)-2-pyridinyl]-4-pyrazolyl]ethyl] ester IUPAC Name: [2-imino-2-[5-methyl-1-[6-methyl-4-(trifluoromethyl)pyridin-2-yl]pyrazol-4-yl]ethyl] benzoate Traditional Name: benzoic acid [2-imino-2-[5-methyl-1-[6-methyl-4-(trifluoromethyl)-2-pyridyl]pyrazol-4-yl]ethyl] ester Formula: C20H17F3N4O2 MolecularWeight: 402.36979

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=C1)C(F)(F)F)N2C(=C(C=N2)C(=N)COC(=O)C3=CC=CC=C3)C

Isomeric SMILES

CC1=NC(=CC(=C1)C(F)(F)F)N2C(=C(C=N2)C(=N)COC(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C20H17F3N4O2/c1-12-8-15(20(21,22)23)9-18(26-12)27-13(2)16(10-25-27)17(24)11-29-19(28)14-6-4-3-5-7-14/h3-10,24H,11H2,1-2H3