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

Systemtic Name: tert-butyl 2-cyano-4-[(3-cyanopyridin-2-yl)amino]-2-pyrrolidin-2-ylcarbonyl-pyrrolidine-1-carboxylate Openeye Name: tert-butyl 2-cyano-4-[(3-cyano-2-pyridyl)amino]-2-(pyrrolidine-2-carbonyl)pyrrolidine-1-carboxylate CAS Name: 2-cyano-4-[(3-cyano-2-pyridinyl)amino]-2-[oxo(2-pyrrolidinyl)methyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-cyano-4-[(3-cyanopyridin-2-yl)amino]-2-(pyrrolidine-2-carbonyl)pyrrolidine-1-carboxylate Traditional Name: 2-cyano-4-[(3-cyano-2-pyridyl)amino]-2-prolyl-pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C21H26N6O3 MolecularWeight: 410.46954

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N6O3/c1-20(2,3)30-19(29)27-12-15(26-18-14(11-22)6-4-9-25-18)10-21(27,13-23)17(28)16-7-5-8-24-16/h4,6,9,15-16,24H,5,7-8,10,12H2,1-3H3,(H,25,26)