ethyl 5-azanyl-3-cyclopentyl-1-[5-(trifluoromethyl)pyridin-2-yl]pyrazole-4-carboxylate

Systemtic Name: ethyl 5-azanyl-3-cyclopentyl-1-[5-(trifluoromethyl)pyridin-2-yl]pyrazole-4-carboxylate Openeye Name: ethyl 5-amino-3-cyclopentyl-1-[5-(trifluoromethyl)-2-pyridyl]pyrazole-4-carboxylate CAS Name: 5-amino-3-cyclopentyl-1-[5-(trifluoromethyl)-2-pyridinyl]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-3-cyclopentyl-1-[5-(trifluoromethyl)pyridin-2-yl]pyrazole-4-carboxylate Traditional Name: 5-amino-3-cyclopentyl-1-[5-(trifluoromethyl)-2-pyridyl]pyrazole-4-carboxylic acid ethyl ester Formula: C17H19F3N4O2 MolecularWeight: 368.35357

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1C2CCCC2)C3=NC=C(C=C3)C(F)(F)F)N

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1C2CCCC2)C3=NC=C(C=C3)C(F)(F)F)N

InChI

InChI=1S/C17H19F3N4O2/c1-2-26-16(25)13-14(10-5-3-4-6-10)23-24(15(13)21)12-8-7-11(9-22-12)17(18,19)20/h7-10H,2-6,21H2,1H3