1-[6-Chloro-2-(methylthio)-4-pyrimidinyl]-4-piperidinecarboxylic acid

CAS Registry Number®

1261231-45-1
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CAS Name

1-[6-Chloro-2-(methylthio)-4-pyrimidinyl]-4-piperidinecarboxylic acid

Molecular Formula

C11H14ClN3O2S

Molecular Mass

287.77

Cite this Page

1-[6-Chloro-2-(methylthio)-4-pyrimidinyl]-4-piperidinecarboxylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1261231-45-1 (retrieved 2024-08-22) (CAS RN: 1261231-45-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C11H14ClN3O2S/c1-18-11-13-8(12)6-9(14-11)15-4-2-7(3-5-15)10(16)17/h6-7H,2-5H2,1H3,(H,16,17)

InChIKey

InChIKey=BKYHCPPANKRMRR-UHFFFAOYSA-N

SMILES

S(C)C=1N=C(N2CCC(C(O)=O)CC2)C=C(Cl)N1

Canonical SMILES

O=C(O)C1CCN(C2=NC(=NC(Cl)=C2)SC)CC1

Other Names for this Substance

  • 4-Piperidinecarboxylic acid, 1-[6-chloro-2-(methylthio)-4-pyrimidinyl]-
  • 1-[6-Chloro-2-(methylthio)-4-pyrimidinyl]-4-piperidinecarboxylic acid