HRID836270

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID949

N,N-Dimethylaniline

C8H11N

HCID962

Water

H2O

HCID24386

Thionyl chloride

Cl2OS

HCID31275

1,4-Dioxane

C4H8O2

HCID348591

9H-Fluorene-2-carboxylic acid

C14H10O2

HCID15547048

10,11-Dihydro-5H-pyrrolo[2,1-c][1,4]benzodiazepine

C12H12N2

HCID17815629

未命名化合物

PRODUCTS

生成物

结构：O=C(c1ccc2c(c1)Cc1ccccc1-2)N1Cc2cccn2Cc2ccccc21

HCID68690693

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-57bd037d929e4f50b0671d7e4f1dc834
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[CH2:60]1[O:61][CH2:62][CH2:63][O:64][CH2:65]1.[CH3:51][N:52]([c:53]1[cH:54][cH:55][cH:56][cH:57][cH:58]1)[CH3:59].[OH2:66].[S:47]([Cl:48])([Cl:49])=[O:50].[cH:15]1[c:16]([C:28](=[O:29])[Cl:30])[cH:17][cH:18][c:19]2[c:27]1[CH2:26][c:25]1[c:20]-2[cH:21][cH:22][cH:23][cH:24]1.[cH:1]1[cH:2][cH:3][n:4]2[c:5]1[CH2:6][NH:7][c:8]1[c:9]([cH:11][cH:12][cH:13][cH:14]1)[CH2:10]2.[cH:31]1[c:32]2[c:40]([cH:41][cH:42][c:43]1[C:44]([OH:45])=[O:46])-[c:35]1[c:34]([cH:39][cH:38][cH:37][cH:36]1)[CH2:33]2>>[cH:1]1[cH:2][cH:3][n:4]2[c:5]1[CH2:6][N:7]([C:28]([c:16]1[cH:15][c:27]3[c:19]([cH:18][cH:17]1)-[c:20]1[cH:21][cH:22][cH:23][cH:24][c:25]1[CH2:26]3)=[O:29])[c:8]1[c:9]([cH:11][cH:12][cH:13][cH:14]1)[CH2:10]2