Catalog Number:
AG001NRJ
Chemical Name:
1H-Purine-2,6-dione, 3,7-dihydro-8-[(1E)-2-(4-methoxy-2,3-dimethylphenyl)ethenyl]-1,3-dimethyl- (9CI)
CAS Number:
155271-16-2
Molecular Formula:
C18H20N4O3
Molecular Weight:
340.3764
MDL Number:
MFCD01757860
IUPAC Name:
8-[(E)-2-(4-methoxy-2,3-dimethylphenyl)ethenyl]-1,3-dimethyl-7H-purine-2,6-dione
InChI:
InChI=1S/C18H20N4O3/c1-10-11(2)13(25-5)8-6-12(10)7-9-14-19-15-16(20-14)21(3)18(24)22(4)17(15)23/h6-9H,1-5H3,(H,19,20)/b9-7+
InChI Key:
YRUNUVOGMHQOPX-VQHVLOKHSA-N
SMILES:
COc1ccc(c(c1C)C)/C=C/c1nc2c([nH]1)c(=O)n(c(=O)n2C)C