Catalog Number:
AG008XL1
Chemical Name:
tert-Butyl 2,4-dichloro-5,6,8,9-tetrahydropyrimido[4,5-d]azepine-7-carboxylate
CAS Number:
1065114-27-3
Molecular Formula:
C13H17Cl2N3O2
Molecular Weight:
318.1990
MDL Number:
MFCD11111564
IUPAC Name:
tert-butyl 2,4-dichloro-5,6,8,9-tetrahydropyrimido[4,5-d]azepine-7-carboxylate
InChI:
InChI=1S/C13H17Cl2N3O2/c1-13(2,3)20-12(19)18-6-4-8-9(5-7-18)16-11(15)17-10(8)14/h4-7H2,1-3H3
InChI Key:
HNTXDMDMFRAXNR-UHFFFAOYSA-N
SMILES:
O=C(N1CCc2c(CC1)c(Cl)nc(n2)Cl)OC(C)(C)C
