HRID589514

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：CN(C)C(=O)N1CC=C(c2cc3c(-c4cccc(N5CCc6cc(C(C)(C)O)ccc6C5=O)c4CO)ncnc3[nH]2)CC1

HCID71230822

未命名化合物

PRODUCTS

生成物

结构：Cc1c(NC(=O)c2ccc(C(C)(C)C)cc2)cc(F)cc1-c1ncnc2[nH]c(C3=CCOCC3)cc12

HCID71230860

未命名化合物

PROCEDURE

实验过程

Example 49 was prepared analogue to Intermediate 6 by replacing Intermediate 3 with Intermediate 11 and Intermediate 5 with Intermediate 38.

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-25115931884a4f619248893e14bd7cff
来源数据集: uspto-grants-2016_01
DOI: 10.6084/m9.figshare.5104873.v1
专利: US09233111B2
来源说明: uspto-grants-2016_01

反应 SMILES

CN(C)C(N1CC=C(C2NC3N=CN=C(C4C=C(F)C=C(N)C=4C)C=3C=2)CC1)=O.Cl[C:31]1[C:32]2[CH:39]=[C:38]([C:40]3[CH2:41][CH2:42][O:43][CH2:44][CH:45]=3)[NH:37][C:33]=2[N:34]=[CH:35][N:36]=1.CN(C)C(N1CC=C(C2NC3N=CN=C(C4C=CC=C(N5CCC6C(=CC=C(C(O)(C)C)C=6)C5=O)C=4CO)C=3C=2)CC1)=O.[C:89]([C:93]1[CH:118]=[CH:117][C:96]([C:97]([NH:99][C:100]2[CH:105]=[C:104]([F:106])[CH:103]=[C:102](B3OC(C)(C)C(C)(C)O3)[C:101]=2[CH3:116])=[O:98])=[CH:95][CH:94]=1)([CH3:92])([CH3:91])[CH3:90]>>[C:89]([C:93]1[CH:118]=[CH:117][C:96]([C:97]([NH:99][C:100]2[CH:105]=[C:104]([F:106])[CH:103]=[C:102]([C:31]3[C:32]4[CH:39]=[C:38]([C:40]5[CH2:41][CH2:42][O:43][CH2:44][CH:45]=5)[NH:37][C:33]=4[N:34]=[CH:35][N:36]=3)[C:101]=2[CH3:116])=[O:98])=[CH:95][CH:94]=1)([CH3:92])([CH3:90])[CH3:91]