HRID1641156

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：CS(=O)(=O)c1nccc(Oc2ccc(NC(=O)c3cc(F)cc(N4CCOCC4)c3)c3ccccc23)n1

HCID59553095

未命名化合物

HCID178485088

未命名化合物

PRODUCTS

生成物

结构：CN(C(=N)N)c1nccc(Oc2ccc(NC(=O)c3cc(F)cc(N4CCOCC4)c3)c3ccccc23)n1

HCID59553380

未命名化合物

PROCEDURE

实验过程

Compound is prepared from 3-fluoro-N-(4-{[2-(methylsulfonyl)pyrimidin-4-yl]oxy}-1-naphthyl)-5-morpholin-4-ylbenzamide and N-methylguanidine according to conditions described in general procedure C. Mp: 155-157° C.; 1H NMR (400 MHz, DMSO-d6) δ 3.19-3.33(m, 7 H), 3.75-3.78(m, 4 H), 6.50(d, J=5.5 Hz, 1H), 7.04(d, J=12.0 Hz, 1 H), 7.27(d, J=9.1 Hz, 1 H), 7.34-7.68(m, 7 H), 7.80(d, J=8.8 Hz, 1H), 7.99(d, J=8.2 Hz, 1 H), 8.29(d, J=5.5 Hz, 1 H), 10.47(s, 1 H).

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f5f5303085ad4b9abc95b857324a7245
来源数据集: uspto-grants-2012_02
DOI: 10.6084/m9.figshare.5104873.v1
专利: US08114873B2
来源说明: uspto-grants-2012_02

反应 SMILES

[F:1][C:2]1[CH:3]=[C:4]([CH:29]=[C:30]([N:32]2[CH2:37][CH2:36][O:35][CH2:34][CH2:33]2)[CH:31]=1)[C:5]([NH:7][C:8]1[C:17]2[C:12](=[CH:13][CH:14]=[CH:15][CH:16]=2)[C:11]([O:18][C:19]2[CH:24]=[CH:23][N:22]=[C:21](S(C)(=O)=O)[N:20]=2)=[CH:10][CH:9]=1)=[O:6].[CH3:38][NH:39][C:40]([NH2:42])=[NH:41]>>[NH2:42][C:40]([N:39]([CH3:38])[C:21]1[N:20]=[C:19]([O:18][C:11]2[C:12]3[C:17](=[CH:16][CH:15]=[CH:14][CH:13]=3)[C:8]([NH:7][C:5](=[O:6])[C:4]3[CH:29]=[C:30]([N:32]4[CH2:37][CH2:36][O:35][CH2:34][CH2:33]4)[CH:31]=[C:2]([F:1])[CH:3]=3)=[CH:9][CH:10]=2)[CH:24]=[CH:23][N:22]=1)=[NH:41]