HRID955183

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID7912

Diisopropylamine

C6H15N

HCID8028

Tetrahydrofuran

C4H8O

HCID83717

Copper iodide (CuI2)

CuI2

HCID11073648

n-boc-propargylamine

C8H13NO2

结构：Cc1ccc(Oc2ccc(Nc3ncnc4ccc(I)cc34)cc2C)cn1

HCID11282772

(6-Iodo-quinazolin-4-yl)-[3-methyl-4-(6-methyl-pyridin-3-yloxy)-phenyl]-amine

C21H17IN4O

PRODUCTS

生成物

结构：Cc1ccc(Oc2ccc(Nc3ncnc4ccc(C#CCNC(=O)OC(C)(C)C)cc34)cc2C)cn1

HCID66623656

1,1-Dimethylethyl N-[3-[4-[[3-methyl-4-[(6-methyl-3-pyridinyl)oxy]phenyl]amino]-6-quinazolinyl]-2-propyn-1-yl]carbamate

C29H29N5O3

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a8f488120d69463cb1544857d934824a
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][CH2:8][C:9]#[CH:10])=[O:11].[CH2:47]1[O:48][CH2:49][CH2:50][CH2:51]1.[CH:40]([NH:41][CH:42]([CH3:43])[CH3:44])([CH3:45])[CH3:46].[ClH:12].[Cu:52]([I:53])[I:54].[I:13][c:14]1[cH:15][c:16]2[c:17]([NH:24][c:25]3[cH:26][c:27]([CH3:39])[c:28]([O:31][c:32]4[cH:33][n:34][c:35]([CH3:38])[cH:36][cH:37]4)[cH:29][cH:30]3)[n:18][cH:19][n:20][c:21]2[cH:22][cH:23]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][CH2:8][C:9]#[C:10][c:14]1[cH:15][c:16]2[c:17]([NH:24][c:25]3[cH:26][c:27]([CH3:39])[c:28]([O:31][c:32]4[cH:33][n:34][c:35]([CH3:38])[cH:36][cH:37]4)[cH:29][cH:30]3)[n:18][cH:19][n:20][c:21]2[cH:22][cH:23]1)=[O:11]