HRID149689

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID6212

Chloroform

CHCl3

HCID81531

Diisopropylethylamine

C8H19N

HCID82634

1,3,4-Thiadiazol-2-amine, 5-(trifluoromethyl)-

C3H2F3N3S

HCID94429

Triphosgene

C3Cl6O3

HCID11594543

4-(6,7-DIMETHOXY-QUINOLIN-4-YLOXY)-PHENYLAMINE

C17H16N2O3

PRODUCTS

生成物

结构：COc1cc2nccc(Oc3ccc(NC(=O)Nc4nnc(C(F)(F)F)s4)cc3)c2cc1OC

HCID23118608

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-22e1a69538854568a92eca94b17055e3
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

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