HRID694105

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID6212

Chloroform

CHCl3

HCID8471

Triethylamine

C6H15N

HCID87984

N-Ethyl-N-(3-methylphenyl)ethane-1,2-diamine

C11H18N2

HCID94429

Triphosgene

C3Cl6O3

HCID21890439

未命名化合物

PRODUCTS

生成物

结构：CCN(CCNC(=O)Nc1ccc(Oc2ccnc3cc(OC)c(OC)cc23)c(C)c1C)c1cccc(C)c1

HCID21891046

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-01115ac827f44653b329d09b7149959e
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

[CH2:44]([CH3:45])[N:46]([CH2:47][CH2:48][NH2:49])[c:50]1[cH:51][c:52]([CH3:56])[cH:53][cH:54][cH:55]1.[CH3:1][O:2][c:3]1[cH:4][c:5]2[c:6]([O:15][c:16]3[c:17]([CH3:24])[c:18]([CH3:23])[c:19]([NH2:20])[cH:21][cH:22]3)[cH:7][cH:8][n:9][c:10]2[cH:11][c:12]1[O:13][CH3:14].[CH3:25][CH2:26][N:27]([CH2:28][CH3:29])[CH2:30][CH3:31].[CH:57]([Cl:58])([Cl:59])[Cl:60].[Cl:32][C:33]([Cl:34])([O:35][C:36]([O:37][C:38]([Cl:39])([Cl:40])[Cl:41])=[O:42])[Cl:43].[OH2:61]>>[CH3:1][O:2][c:3]1[cH:4][c:5]2[c:6]([O:15][c:16]3[c:17]([CH3:24])[c:18]([CH3:23])[c:19]([NH:20][C:36](=[O:42])[NH:49][CH2:48][CH2:47][N:46]([CH2:44][CH3:45])[c:50]4[cH:51][c:52]([CH3:56])[cH:53][cH:54][cH:55]4)[cH:21][cH:22]3)[cH:7][cH:8][n:9][c:10]2[cH:11][c:12]1[O:13][CH3:14]