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

Systemtic Name: ethyl 2-[2-(4-tert-butylphenyl)carbonylhydrazinyl]-4-(trifluoromethyl)pyrimidine-5-carboxylate Openeye Name: ethyl 2-[2-(4-tert-butylbenzoyl)hydrazino]-4-(trifluoromethyl)pyrimidine-5-carboxylate CAS Name: 2-[[(4-tert-butylphenyl)-oxomethyl]hydrazo]-4-(trifluoromethyl)-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[2-(4-tert-butylbenzoyl)hydrazinyl]-4-(trifluoromethyl)pyrimidine-5-carboxylate Traditional Name: 2-[N'-(4-tert-butylbenzoyl)hydrazino]-4-(trifluoromethyl)pyrimidine-5-carboxylic acid ethyl ester Formula: C19H21F3N4O3 MolecularWeight: 410.39025

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21F3N4O3/c1-5-29-16(28)13-10-23-17(24-14(13)19(20,21)22)26-25-15(27)11-6-8-12(9-7-11)18(2,3)4/h6-10H,5H2,1-4H3,(H,25,27)(H,23,24,26)