HRID673580

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID81184

1,8-Diazabicyclo[5.4.0]undec-7-ene

C9H16N2

HCID199401

Phosphinic azide, diphenyl-

C12H10N3OP

结构：O=C1C(C2=NS(=O)(=O)c3c(CO)csc3N2)=C(O)C2C3CCC(C3)C2N1Cc1ccc(F)cc1

HCID178515438

未命名化合物

PRODUCTS

生成物

结构：[N-]=[N+]=NCc1csc2c1S(=O)(=O)N=C(C1=C(O)C3C4CCC(C4)C3N(Cc3ccc(F)cc3)C1=O)N2

HCID136391035

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-08147b10778841bfb0bbb3cf6a43cb96
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

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