tert-butyl 2-(4-pyrimidin-2-ylpiperazin-1-yl)carbonylpyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 2-(4-pyrimidin-2-ylpiperazin-1-yl)carbonylpyrrolidine-1-carboxylate Openeye Name: tert-butyl 2-(4-pyrimidin-2-ylpiperazine-1-carbonyl)pyrrolidine-1-carboxylate CAS Name: 2-[oxo-[4-(2-pyrimidinyl)-1-piperazinyl]methyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-(4-pyrimidin-2-ylpiperazine-1-carbonyl)pyrrolidine-1-carboxylate Traditional Name: 2-[4-(2-pyrimidyl)piperazine-1-carbonyl]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C18H27N5O3 MolecularWeight: 361.43868

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC1C(=O)N2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC1C(=O)N2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C18H27N5O3/c1-18(2,3)26-17(25)23-9-4-6-14(23)15(24)21-10-12-22(13-11-21)16-19-7-5-8-20-16/h5,7-8,14H,4,6,9-13H2,1-3H3