HRID826511

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8471

Triethylamine

C6H15N

HCID26255

Tetrafluoroborate

BF4-

HCID130500

未命名化合物

HCID11183144

2-[(5-Chloro-2-thienyl)oxy]acetic acid

C6H5ClO3S

HCID77566638

未命名化合物

PRODUCTS

生成物

结构：COCC1C(=O)N(Cc2cnc(NCCN(C)C)nc2)CCN1C(=O)COc1ccc(Cl)s1

HCID77167201

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-9c9fed72517d48faa4905b65c2ecdcc5
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

[B-:35]([F:36])([F:37])([F:38])[F:39].[CH3:1][N:2]([CH3:3])[CH2:4][CH2:5][NH:6][c:7]1[n:8][cH:9][c:10]([CH2:13][N:14]2[C:15](=[O:23])[CH:16]([CH2:20][O:21][CH3:22])[NH:17][CH2:18][CH2:19]2)[cH:11][n:12]1.[CH3:57][CH2:58][N:59]([CH2:60][CH3:61])[CH2:62][CH3:63].[Cl:24][c:25]1[cH:26][cH:27][c:28]([O:30][CH2:31][C:32](=[O:33])[OH:34])[s:29]1.[O:64]=[CH:65][N:66]([CH3:67])[CH3:68].[n:40]1([O:41][C:42]([N:43]([CH3:44])[CH3:45])=[N+:46]([CH3:47])[CH3:48])[c:49]2[cH:50][cH:51][cH:52][cH:53][c:54]2[n:55][n:56]1>>[CH3:1][N:2]([CH3:3])[CH2:4][CH2:5][NH:6][c:7]1[n:8][cH:9][c:10]([CH2:13][N:14]2[C:15](=[O:23])[CH:16]([CH2:20][O:21][CH3:22])[N:17]([C:32]([CH2:31][O:30][c:28]3[cH:27][cH:26][c:25]([Cl:24])[s:29]3)=[O:33])[CH2:18][CH2:19]2)[cH:11][n:12]1