4-(Methylthio)-1H-pyrazolo[3,4-d]pyrimidine

CAS Registry Number®

5418-10-0

CAS Name

4-(Methylthio)-1H-pyrazolo[3,4-d]pyrimidine

Molecular Formula

C6H6N4S

Molecular Mass

166.20

Cite this Page

4-(Methylthio)-1H-pyrazolo[3,4-d]pyrimidine.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=5418-10-0 (retrieved 2024-12-19) (CAS RN: 5418-10-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    193-194 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C6H6N4S/c1-11-6-4-2-9-10-5(4)7-3-8-6/h2-3H,1H3,(H,7,8,9,10)

InChIKey

InChIKey=BLEJJILOVWBLBZ-UHFFFAOYSA-N

SMILES

S(C)C1=C2C(NN=C2)=NC=N1

Canonical SMILES

N1=CC=2C(=NC=NC2N1)SC

Other Names for this Substance

  • 1H-Pyrazolo[3,4-d]pyrimidine, 4-(methylthio)-
  • 4-(Methylthio)-1H-pyrazolo[3,4-d]pyrimidine
  • 4-Methylthiopyrazolo[3,4-d]pyrimidine
  • NSC 4938
  • NSC 4952

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