tert-butyl (2R)-1-[2-[3-(5-cyanopyridin-2-yl)imidazolidin-1-yl]ethanoyl]pyrrolidine-2-carboxylate

Systemtic Name: tert-butyl (2R)-1-[2-[3-(5-cyanopyridin-2-yl)imidazolidin-1-yl]ethanoyl]pyrrolidine-2-carboxylate Openeye Name: tert-butyl (2R)-1-[2-[3-(5-cyano-2-pyridyl)imidazolidin-1-yl]acetyl]pyrrolidine-2-carboxylate CAS Name: (2R)-1-[2-[3-(5-cyano-2-pyridinyl)-1-imidazolidinyl]-1-oxoethyl]-2-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2R)-1-[2-[3-(5-cyanopyridin-2-yl)imidazolidin-1-yl]acetyl]pyrrolidine-2-carboxylate Traditional Name: (2R)-1-[2-[3-(5-cyano-2-pyridyl)imidazolidin-1-yl]acetyl]pyrrolidine-2-carboxylic acid tert-butyl ester Formula: C20H27N5O3 MolecularWeight: 385.46008

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1CCCN1C(=O)CN2CCN(C2)C3=NC=C(C=C3)C#N

Isomeric SMILES

CC(C)(C)OC(=O)[C@H]1CCCN1C(=O)CN2CCN(C2)C3=NC=C(C=C3)C#N

InChI

InChI=1S/C20H27N5O3/c1-20(2,3)28-19(27)16-5-4-8-25(16)18(26)13-23-9-10-24(14-23)17-7-6-15(11-21)12-22-17/h6-7,12,16H,4-5,8-10,13-14H2,1-3H3/t16-/m1/s1