HRID116759

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID8502

4-Nitrobenzoyl chloride

C7H4ClNO3

HCID4416939

1-Boc-3-hydroxypyrrolidine

C9H17NO3

结构：CS(=O)(=O)c1ccc2c(c1)CCN2c1cc(OC2CCNCC2)ncn1

HCID66709668

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)N1CCC(OC(=O)N2CCC(Oc3cc(N4CCc5cc(S(C)(=O)=O)ccc54)ncn3)CC2)C1

HCID66894357

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ef02ee2f8b8040b8bac19a5884b305b7
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

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