CAS Registry Number: 1618-36-6

Name:

7H-​Pyrrolo[2,​3-​d]​pyrimidine, 4-​chloro-​5-​methyl-
4-​Chloro-​5-​methyl-​7H-​pyrrolo[2,​3-​d]​pyrimidine 

Chemical Formula: C7H6ClN3
Exact Mass: 167.03
Molecular Weight: 167.60
m/z: 167.03 (100.0%), 169.02 (32.0%), 168.03 (7.6%), 170.03 (2.4%), 168.02 (1.1%)

InChI: InChI=1S/C7H6ClN3/c1-4-2-9-7-5(4)6(8)10-3-11-7/h2-3H,1H3,(H,9,10,11)
InChIKey: NISJMYPRXDUYTF-UHFFFAOYSA-N
Canonical SMILES : CC1=CNC2=C1C(=NC=N2)Cl

Specification

98%

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4. (4) Pudlo, Jeffrey S.; Journal of Medicinal Chemistry 1990, V33(7), P1984-92 CAPLUS
5. (5) GB 981458 1965 CAPLUS