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

Systemtic Name: ethyl 5-azanyl-3-cyclobutyl-1-[5-(trifluoromethyl)pyridin-2-yl]pyrazole-4-carboxylate Openeye Name: ethyl 5-amino-3-cyclobutyl-1-[5-(trifluoromethyl)-2-pyridyl]pyrazole-4-carboxylate CAS Name: 5-amino-3-cyclobutyl-1-[5-(trifluoromethyl)-2-pyridinyl]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-3-cyclobutyl-1-[5-(trifluoromethyl)pyridin-2-yl]pyrazole-4-carboxylate Traditional Name: 5-amino-3-cyclobutyl-1-[5-(trifluoromethyl)-2-pyridyl]pyrazole-4-carboxylic acid ethyl ester Formula: C16H17F3N4O2 MolecularWeight: 354.32699

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1C2CCC2)C3=NC=C(C=C3)C(F)(F)F)N

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1C2CCC2)C3=NC=C(C=C3)C(F)(F)F)N

InChI

InChI=1S/C16H17F3N4O2/c1-2-25-15(24)12-13(9-4-3-5-9)22-23(14(12)20)11-7-6-10(8-21-11)16(17,18)19/h6-9H,2-5,20H2,1H3