tert-butyl 2-cyano-2-pyrrolidin-2-ylcarbonyl-4-[[3-(trifluoromethyl)pyridin-2-yl]amino]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 2-cyano-2-pyrrolidin-2-ylcarbonyl-4-[[3-(trifluoromethyl)pyridin-2-yl]amino]pyrrolidine-1-carboxylate Openeye Name: tert-butyl 2-cyano-2-(pyrrolidine-2-carbonyl)-4-[[3-(trifluoromethyl)-2-pyridyl]amino]pyrrolidine-1-carboxylate CAS Name: 2-cyano-2-[oxo(2-pyrrolidinyl)methyl]-4-[[3-(trifluoromethyl)-2-pyridinyl]amino]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-cyano-2-(pyrrolidine-2-carbonyl)-4-[[3-(trifluoromethyl)pyridin-2-yl]amino]pyrrolidine-1-carboxylate Traditional Name: 2-cyano-2-prolyl-4-[[3-(trifluoromethyl)-2-pyridyl]amino]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C21H26F3N5O3 MolecularWeight: 453.45805

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC(CC1(C#N)C(=O)C2CCCN2)NC3=C(C=CC=N3)C(F)(F)F

Isomeric SMILES

CC(C)(C)OC(=O)N1CC(CC1(C#N)C(=O)C2CCCN2)NC3=C(C=CC=N3)C(F)(F)F

InChI

InChI=1S/C21H26F3N5O3/c1-19(2,3)32-18(31)29-11-13(28-17-14(21(22,23)24)6-4-9-27-17)10-20(29,12-25)16(30)15-7-5-8-26-15/h4,6,9,13,15,26H,5,7-8,10-11H2,1-3H3,(H,27,28)