ethyl 2-[2-(2-methylphenyl)carbonylhydrazinyl]-4-(trifluoromethyl)pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-[2-(2-methylphenyl)carbonylhydrazinyl]-4-(trifluoromethyl)pyrimidine-5-carboxylate Openeye Name: ethyl 2-[2-(2-methylbenzoyl)hydrazino]-4-(trifluoromethyl)pyrimidine-5-carboxylate CAS Name: 2-[[(2-methylphenyl)-oxomethyl]hydrazo]-4-(trifluoromethyl)-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[2-(2-methylbenzoyl)hydrazinyl]-4-(trifluoromethyl)pyrimidine-5-carboxylate Traditional Name: 2-(N'-o-toluoylhydrazino)-4-(trifluoromethyl)pyrimidine-5-carboxylic acid ethyl ester Formula: C16H15F3N4O3 MolecularWeight: 368.31051

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1C(F)(F)F)NNC(=O)C2=CC=CC=C2C

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1C(F)(F)F)NNC(=O)C2=CC=CC=C2C

InChI

InChI=1S/C16H15F3N4O3/c1-3-26-14(25)11-8-20-15(21-12(11)16(17,18)19)23-22-13(24)10-7-5-4-6-9(10)2/h4-8H,3H2,1-2H3,(H,22,24)(H,20,21,23)