ethyl 1-[4-[(pyridin-2-ylcarbonylamino)carbamoyl]phenyl]-5-(trifluoromethyl)pyrazole-4-carboxylate

Systemtic Name: ethyl 1-[4-[(pyridin-2-ylcarbonylamino)carbamoyl]phenyl]-5-(trifluoromethyl)pyrazole-4-carboxylate Openeye Name: ethyl 1-[4-[(pyridine-2-carbonylamino)carbamoyl]phenyl]-5-(trifluoromethyl)pyrazole-4-carboxylate CAS Name: 1-[4-[oxo-[[oxo(2-pyridinyl)methyl]hydrazo]methyl]phenyl]-5-(trifluoromethyl)-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-[(pyridine-2-carbonylamino)carbamoyl]phenyl]-5-(trifluoromethyl)pyrazole-4-carboxylate Traditional Name: 1-[4-(picolinamidocarbamoyl)phenyl]-5-(trifluoromethyl)pyrazole-4-carboxylic acid ethyl ester Formula: C20H16F3N5O4 MolecularWeight: 447.36735

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C(=O)NNC(=O)C3=CC=CC=N3)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C(=O)NNC(=O)C3=CC=CC=N3)C(F)(F)F

InChI

InChI=1S/C20H16F3N5O4/c1-2-32-19(31)14-11-25-28(16(14)20(21,22)23)13-8-6-12(7-9-13)17(29)26-27-18(30)15-5-3-4-10-24-15/h3-11H,2H2,1H3,(H,26,29)(H,27,30)