Catalog Number:
AG007X11
Chemical Name:
tert-Butyl 4-chloro-8,9-dihydro-5h-pyrimido[5,4-d]azepine-7(6h)-carboxylate
CAS Number:
1057338-27-8
Molecular Formula:
C13H18ClN3O2
Molecular Weight:
283.7539
MDL Number:
MFCD11045433
IUPAC Name:
tert-butyl 4-chloro-5,6,8,9-tetrahydropyrimido[4,5-d]azepine-7-carboxylate
InChI:
InChI=1S/C13H18ClN3O2/c1-13(2,3)19-12(18)17-6-4-9-10(5-7-17)15-8-16-11(9)14/h8H,4-7H2,1-3H3
InChI Key:
OWQQLMMARYLDAW-UHFFFAOYSA-N
SMILES:
O=C(N1CCc2c(CC1)ncnc2Cl)OC(C)(C)C
