HRID282065

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID887

Methanol

CH4O

HCID923

Sodium ion

Na+

HCID962

Water

H2O

HCID6344

Dichloromethane

CH2Cl2

HCID28123

Tetrahydroborate

H4B-

HCID13963151

未命名化合物

结构：Cc1nc(NC(=O)C2(c3ccc4c(c3)OCO4)CC2)sc1C(N)c1ccccc1Cl

HCID76672719

未命名化合物

PRODUCTS

生成物

结构：Cc1nc(NC(=O)C2(c3ccc4c(c3)OCO4)CC2)sc1C(c1ccccc1Cl)N1CCC(O[Si](C)(C)C(C)(C)C)C1

HCID76672748

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-3148be612cf74948933162b93119d865
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

[BH4-:45].[C:31]([CH3:32])([CH3:33])([CH3:34])[Si:35]([O:36][CH:37]([CH2:38][CH:39]=[O:42])[CH2:41][Cl:40])([CH3:43])[CH3:44].[CH3:50][OH:51].[Cl:47][CH2:48][Cl:49].[NH2:1][CH:2]([c:3]1[c:4]([CH3:23])[n:5][c:6]([NH:8][C:9](=[O:10])[C:11]2([c:14]3[cH:15][c:16]4[c:17]([cH:21][cH:22]3)[O:18][CH2:19][O:20]4)[CH2:12][CH2:13]2)[s:7]1)[c:24]1[c:25]([Cl:30])[cH:26][cH:27][cH:28][cH:29]1.[Na+:46].[OH2:52]>>[N:1]1([CH:2]([c:3]2[c:4]([CH3:23])[n:5][c:6]([NH:8][C:9](=[O:10])[C:11]3([c:14]4[cH:15][c:16]5[c:17]([cH:21][cH:22]4)[O:18][CH2:19][O:20]5)[CH2:12][CH2:13]3)[s:7]2)[c:24]2[c:25]([Cl:30])[cH:26][cH:27][cH:28][cH:29]2)[CH2:39][CH2:38][CH:37]([O:36][Si:35]([C:31]([CH3:32])([CH3:33])[CH3:34])([CH3:43])[CH3:44])[CH2:41]1