HRID1561092

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6212

Chloroform

CHCl3

HCID8471

Triethylamine

C6H15N

HCID15908

1-Ethyl-3-(3'-dimethylaminopropyl)carbodiimide

C8H17N3

HCID313342

5-amino-1-methyl-1H-pyrazole-4-carboxylic acid

C5H7N3O2

HCID2794294

N-tritylethylenediamine

C21H22N2

PRODUCTS

生成物

结构：Cn1ncc(C(=O)NCCNC(c2ccccc2)(c2ccccc2)c2ccccc2)c1N

HCID18442395

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-65c2557b0e6f4b628635320ecb3f8f6f
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

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