8-benzylsulfanyl-3-methyl-7-[(4-methylphenyl)methyl]purine-2,6-dione
Molecular Formula:
C
21
H
20
N
4
O
2
S
InChI:
InChI=1/C21H20N4O2S/c1-14-8-10-15(11-9-14)12-25-17-18(24(2)20(27)23-19(17)26)22-21(25)28-13-16-6-4-3-5-7-16/h3-11H,12-13H2,1-2H3,(H,23,26,27)/f/h23H
InChIKey:
InChIKey=RXLJVLBRPNIOKS-MPIMZMORCQ
SMILES:
CC1=CC=C(C=C1)CN2C3=C(N=C2SCC4=CC=CC=C4)N(C(=O)NC3=O)C
Names:
8-benzylsulfanyl-3-methyl-7-[(4-methylphenyl)methyl]purine-2,6-dione
Registries:
PubChem CID 1115604
PubChem ID 6034481