HRID880633

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID5287830

Purine, 6-bromo-

C5H3BrN4

HCID6101139

2-Amino-6-bromopurine

C5H4BrN5

结构：Cc1cccc2nc(C(C)Nc3ncnc4[nH]cc(Br)c34)n(-c3cccc(F)c3)c(=O)c12

HCID11598408

未命名化合物

结构：CC(Nc1ncnc2[nH]cnc12)c1nc2ccccc2c(=O)n1-c1cc(F)cc(F)c1

HCID178463554

未命名化合物

PRODUCTS

生成物

结构：CC(Nc1nc(N)nc2[nH]cnc12)c1nc2ccccc2c(=O)n1-c1cc(F)cc(F)c1

HCID178463608

未命名化合物

PROCEDURE

实验过程

Compound 99 was prepared using the general procedure described above with respect to compound 95, but 2-amino-6-bromopurine was substituted for 6-bromopurine in step D. ESI-MS m/z 435 (MH+). Compound 96 is shown below.

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f2e85b9e33ce4a08bcdacba15eac82b3
来源数据集: uspto-grants-2015_03
DOI: 10.6084/m9.figshare.5104873.v1
专利: US08993583B2
来源说明: uspto-grants-2015_03

反应 SMILES

[F:1][C:2]1[CH:3]=[C:4]([N:9]2[C:18](=[O:19])[C:17]3[C:12](=[CH:13][CH:14]=[CH:15][CH:16]=3)[N:11]=[C:10]2[CH:20]([NH:22][C:23]2[N:31]=[CH:30][N:29]=[C:28]3[C:24]=2[N:25]=[CH:26][NH:27]3)[CH3:21])[CH:5]=[C:6]([F:8])[CH:7]=1.[NH2:32]C1N=C2C(NC=N2)=C(Br)N=1.BrC1N=CN=C2C=1NC=N2.BrC1C2C(NC(C3N(C4C=CC=C(F)C=4)C(=O)C4C(=CC=CC=4C)N=3)C)=NC=NC=2NC=1>>[NH2:32][C:30]1[N:29]=[C:28]2[C:24]([N:25]=[CH:26][NH:27]2)=[C:23]([NH:22][CH:20]([C:10]2[N:9]([C:4]3[CH:3]=[C:2]([F:1])[CH:7]=[C:6]([F:8])[CH:5]=3)[C:18](=[O:19])[C:17]3[C:12](=[CH:13][CH:14]=[CH:15][CH:16]=3)[N:11]=2)[CH3:21])[N:31]=1