CAS Registry Number:5401-15-0
Name:

1-Methyl-1H-pyrazolo[3,4-d]pyrimidine-4,6(5H,7H)-dione

1-Methyl-1,7-dihydro-pyrazolo[3,4-d]pyrimidine-4,6-dione

Chemical Formula: C6H6N4O2
Exact Mass: 166.05
Molecular Weight: 166.14
m/z: 166.05 (100.0%), 167.05 (8.0%)

InChI
InChI=1S/C6H6N4O2/c1-10-4-3(2-7-10)5(11)9-6(12)8-4/h2,7H,1H3,(H,9,11,12)
InChI Key
ROHCWJGFBVBWMO-UHFFFAOYSA-N
Canonical SMILES
CN1C2=NC(=O)NC(=O)C2=CN1

Specification

98%

Tetrahedron Letters (2018), 59(25), 2463-2466

Faming Zhuanli Shenqing (2018), CN 107698587 A 20180216