2-[(4,6-Diamino-2-pyrimidinyl)thio]butanoic acid

CAS Registry Number®

436088-61-8

CAS Name

2-[(4,6-Diamino-2-pyrimidinyl)thio]butanoic acid

Molecular Formula

C8H12N4O2S

Molecular Mass

228.27

Cite this Page

2-[(4,6-Diamino-2-pyrimidinyl)thio]butanoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=436088-61-8 (retrieved 2024-11-24) (CAS RN: 436088-61-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C8H12N4O2S/c1-2-4(7(13)14)15-8-11-5(9)3-6(10)12-8/h3-4H,2H2,1H3,(H,13,14)(H4,9,10,11,12)

InChIKey

InChIKey=SXVWYWGXRFRYMV-UHFFFAOYSA-N

SMILES

S(C(C(O)=O)CC)C=1N=C(N)C=C(N)N1

Canonical SMILES

O=C(O)C(SC=1N=C(N)C=C(N1)N)CC

Other Names for this Substance

  • Butanoic acid, 2-[(4,6-diamino-2-pyrimidinyl)thio]-
  • 2-[(4,6-Diamino-2-pyrimidinyl)thio]butanoic acid
  • 2-(4,6-Diamino-pyrimidin-2-ylsulfanyl)-butyric acid
  • 2-[(4,6-Diaminopyrimidin-2-yl)sulfanyl]butanoic acid

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