Catalog Number:
AG01EK3Y
Chemical Name:
9-(azetidin-3-yl)-9H-purine-2,6-diamine, trifluoroacetic acid
CAS Number:
2126161-71-3
Molecular Formula:
C10H12F3N7O2
Molecular Weight:
319.2432
MDL Number:
MFCD31381225
IUPAC Name:
9-(azetidin-3-yl)purine-2,6-diamine;2,2,2-trifluoroacetic acid
InChI:
InChI=1S/C8H11N7.C2HF3O2/c9-6-5-7(14-8(10)13-6)15(3-12-5)4-1-11-2-4;3-2(4,5)1(6)7/h3-4,11H,1-2H2,(H4,9,10,13,14);(H,6,7)
InChI Key:
LECUWMWFLRLJCF-UHFFFAOYSA-N
SMILES:
OC(=O)C(F)(F)F.Nc1nc(N)c2c(n1)n(cn2)C1CNC1
