HRID2314272

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID9886

Hexafluorophosphate ion

F6P-

HCID81531

Diisopropylethylamine

C8H19N

HCID136429

Diphenylmethane-4-carboxylic acid

C14H12O2

HCID210824

N-Benzyl-2-imino-4-methyl-2,3-dihydro-1,3-thiazole-5-carboximidic acid

C12H13N3OS

HCID4641409

(Dimethylamino)-N,N-dimethyl(3H-[1,2,3]triazolo[4,5-b]pyridin-3-yloxy)methaniminium

C10H15N6O+

PRODUCTS

生成物

结构：Cc1nc(NC(=O)c2ccc(Cc3ccccc3)cc2)sc1C(=O)NCc1ccccc1

HCID59369673

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a2641818bc6240bca6c343f1539d6fa8
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[NH:8][C:9](=[O:10])[c:11]1[c:12]([CH3:17])[n:13][c:14]([NH2:16])[s:15]1.[CH2:27]([c:28]1[cH:29][cH:30][cH:31][cH:32][cH:33]1)[c:34]1[cH:35][cH:36][c:37]([C:38](=[O:39])[OH:40])[cH:41][cH:42]1.[CH3:50][N+:51]([CH3:52])=[C:53]([N:54]([CH3:55])[CH3:56])[O:57][n:58]1[c:59]2[n:60][cH:61][cH:62][cH:63][c:64]2[n:65][n:66]1.[CH:18]([N:19]([CH:20]([CH3:21])[CH3:22])[CH2:23][CH3:24])([CH3:25])[CH3:26].[Cl:67][CH2:68][Cl:69].[F:43][P-:44]([F:45])([F:46])([F:47])([F:48])[F:49]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[NH:8][C:9](=[O:10])[c:11]1[c:12]([CH3:17])[n:13][c:14]([NH:16][C:38]([c:37]2[cH:36][cH:35][c:34]([CH2:27][c:28]3[cH:29][cH:30][cH:31][cH:32][cH:33]3)[cH:42][cH:41]2)=[O:39])[s:15]1