HRID1144027

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID887

Methanol

CH4O

HCID923

Sodium ion

Na+

HCID6341

Ethanamine

C2H7N

HCID6344

Dichloromethane

CH2Cl2

HCID8028

Tetrahydrofuran

C4H8O

HCID28123

Tetrahydroborate

H4B-

结构：CN(C)CCCS(=O)(=O)N1CCC(c2c[nH]c3c(C(N)=O)cc(-c4cccc(C=O)c4)cc23)CC1

HCID59003355

未命名化合物

PRODUCTS

生成物

结构：CCNCc1cccc(-c2cc(C(N)=O)c3[nH]cc(C4CCN(S(=O)(=O)CCCN(C)C)CC4)c3c2)c1

HCID59003305

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-52d469d86e774e27991bae3caed31e4e
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

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