1-(1,1-Dimethylethyl) 4-[2-(methylthio)-4-pyrimidinyl]-1,3-piperazinedicarboxylate

CAS Registry Number®

1261229-73-5

CAS Name

1-(1,1-Dimethylethyl) 4-[2-(methylthio)-4-pyrimidinyl]-1,3-piperazinedicarboxylate

Molecular Formula

C15H22N4O4S

Molecular Mass

354.42

Cite this Page

1-(1,1-Dimethylethyl) 4-[2-(methylthio)-4-pyrimidinyl]-1,3-piperazinedicarboxylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1261229-73-5 (retrieved 2024-11-23) (CAS RN: 1261229-73-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C15H22N4O4S/c1-15(2,3)23-14(22)18-7-8-19(10(9-18)12(20)21)11-5-6-16-13(17-11)24-4/h5-6,10H,7-9H2,1-4H3,(H,20,21)

InChIKey

InChIKey=MWXNLCZXFUJQRX-UHFFFAOYSA-N

SMILES

C(O)(=O)C1N(CCN(C(OC(C)(C)C)=O)C1)C2=NC(SC)=NC=C2

Canonical SMILES

O=C(O)C1N(C2=NC(=NC=C2)SC)CCN(C(=O)OC(C)(C)C)C1

Other Names for this Substance

  • 1,3-Piperazinedicarboxylic acid, 4-[2-(methylthio)-4-pyrimidinyl]-, 1-(1,1-dimethylethyl) ester
  • 1-(1,1-Dimethylethyl) 4-[2-(methylthio)-4-pyrimidinyl]-1,3-piperazinedicarboxylate

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