CAS Registry Number: 914110-66-0
 Name:

Ethyl 6-amino-9-benzyl-8-oxo-8,9-dihydro-7H-purine-2-carboxylate

Chemical Formula: C15H15N5O3
Exact Mass: 313.12
Molecular Weight: 313.31
m/z: 313.12 (100.0%), 314.12 (16.5%), 315.12 (2.1%), 314.11 (1.8%)

InChI
InChI=1S/C15H15N5O3/c1-2-23-14(21)12-18-11(16)10-13(19-12)20(15(22)17-10)8-9-6-4-3-5-7-9/h3-7H,2,8H2,1H3,(H,17,22)(H2,16,18,19)
InChI Key
KGRHJMYCNDUHQL-UHFFFAOYSA-N
Canonical SMILES
CCOC(=O)C1=NC2=C(C(=N1)N)NC(=O)N2CC3=CC=CC=C3

Specification

98%

U.S. (2013), US 8372836 B2 20130212

PCT Int. Appl. (2008), WO 2008047201 A2 20080424