Ethyl 4-[5-[[[(3R)-1-[(1,1-dimethylethoxy)carbonyl]-3-pyrrolidinyl]amino]carbonyl]-2-pyridinyl]-1-piperazinecarboxylate

CAS Registry Number®

2227197-41-1
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CAS Name

Ethyl 4-[5-[[[(3R)-1-[(1,1-dimethylethoxy)carbonyl]-3-pyrrolidinyl]amino]carbonyl]-2-pyridinyl]-1-piperazinecarboxylate

Molecular Formula

C22H33N5O5

Molecular Mass

447.53

Cite this Page

Ethyl 4-[5-[[[(3R)-1-[(1,1-dimethylethoxy)carbonyl]-3-pyrrolidinyl]amino]carbonyl]-2-pyridinyl]-1-piperazinecarboxylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=2227197-41-1 (retrieved 2024-09-10) (CAS RN: 2227197-41-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C22H33N5O5/c1-5-31-20(29)26-12-10-25(11-13-26)18-7-6-16(14-23-18)19(28)24-17-8-9-27(15-17)21(30)32-22(2,3)4/h6-7,14,17H,5,8-13,15H2,1-4H3,(H,24,28)/t17-/m1/s1

InChIKey

InChIKey=IKVZNRKXMFMKNF-QGZVFWFLSA-N

SMILES

C(N[C@H]1CN(C(OC(C)(C)C)=O)CC1)(=O)C2=CC=C(N=C2)N3CCN(C(OCC)=O)CC3

Canonical SMILES

O=C(OCC)N1CCN(C2=NC=C(C=C2)C(=O)NC3CN(C(=O)OC(C)(C)C)CC3)CC1

Other Names for this Substance

  • 1-Piperazinecarboxylic acid, 4-[5-[[[(3R)-1-[(1,1-dimethylethoxy)carbonyl]-3-pyrrolidinyl]amino]carbonyl]-2-pyridinyl]-, ethyl ester
  • Ethyl 4-[5-[[[(3R)-1-[(1,1-dimethylethoxy)carbonyl]-3-pyrrolidinyl]amino]carbonyl]-2-pyridinyl]-1-piperazinecarboxylate