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CAS Number: 57564-94-0
4-chloro-2-(methylthio)-1H-pyrrolo[2,3-d]pyrimidine

Structure

 4-chloro-2-(methylthio)-1H-pyrrolo[2,3-d]pyrimidine
Name: 4-chloro-2-(methylthio)-1H-pyrrolo[2,3-d]pyrimidine
Synonyms:
General Information
Product Number: 57564940

CAS Registry Number 57564-94-0
Name:
7H-?Pyrrolo[2,?3-?d]?pyrimidine, 4-?chloro-?2-?(methylthio)?-
1H-Pyrrolo[2,3-d]pyrimidine, 4-chloro-2-(methylthio)- (9CI)
4-Chloro-2-(methylthio)-7H-pyrrolo[2,3-d]pyrimidine
4-Chloro-2-methylsulfanyl-7H-pyrrolo[2,3-d]pyrimidine
4-Chloro-2-methylthiopyrrolo[2,3-d]pyrimidine
NSC 70903

 

Chemical Formula: C7H6ClN3S
Exact Mass: 199.00
Molecular Weight: 199.66
m/z: 199.00 (100.0%), 200.99 (36.5%), 200.00 (8.4%), 202.00 (2.8%), 202.99 (1.5%), 199.99 (1.1%)

 

InChI:InChI=1S/C7H6ClN3S/c1-12-7-10-5(8)4-2-3-9-6(4)11-7/h2-3H,1H3,(H,9,10,11)

InChI Key:WEGGBXZHIWVHOI-UHFFFAOYSA-N

Canonical SMILES:CSC1=NC2=C(C=CN2)C(=N1)Cl

Specification

98%
References
  1. (1) Williams, David M.; Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry 1995, (10), P1225-31 CAPLUS
  2. (2) Luepke, Uwe; Chemische Berichte 1979, V112(10), P3432-40 CAPLUS
  3. (3) Seela, Frank; Helvetica Chimica Acta 1990, V73(7), P1879-87 CAPLUS
  4. (4) Winkeler, Heinz Dieter; Chemische Berichte 1980, V113(6), P2069-80 CAPLUS
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