HRID2141269

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID6422

未命名化合物

结构：CCNc1ccc(C(=O)OC(C)(C)C)cc1N=C1SC(=C2Sc3ccccc3N2C)C(=O)N1Cc1ccccc1

HCID73855084

3-[3-benzyl-5-(3-methyl-3H-benzothiazol-2-ylidene)-4-oxothiazolidin-2-ylideneamino]-4-ethylaminobenzoic acid tert-butyl ester

C31H32N4O3S2

PRODUCTS

生成物

结构：CCNc1ccc(C(=O)O)cc1N=C1SC(=C2Sc3ccccc3N2C)C(=O)N1Cc1ccccc1

HCID73855012

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f6902ec3d66a4cd881c72e7e964db032
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

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