3-benzyl-8-[2-(4-methylphenoxy)ethylsulfanyl]-7H-purin-6-amine
Molecular Formula:
C
21
H
22
N
5
OS
+
InChI:
InChI=1/C21H21N5OS/c1-15-7-9-17(10-8-15)27-11-12-28-21-24-18-19(22)23-14-26(20(18)25-21)13-16-5-3-2-4-6-16/h2-10,14H,11-13H2,1H3,(H2,22,24,25)/p+1/fC21H22N5OS/h24H,22H2/q+1
InChIKey:
InChIKey=NVTXTFLFJFPCBL-XUALBFOOCI
SMILES:
CC1=CC=C(C=C1)OCCSC2=NC3=[N+](C=NC(=C3N2)N)CC4=CC=CC=C4
Names:
3-benzyl-8-[2-(4-methylphenoxy)ethylsulfanyl]-7H-purin-6-amine
Registries:
PubChem CID 4139351
PubChem ID 6074861