HRID93040

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID176

Acetic Acid

C2H4O2

HCID962

Water

H2O

HCID6212

Chloroform

CHCl3

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID7940

Glutaric anhydride

C5H6O3

HCID8471

Triethylamine

C6H15N

结构：O=C(O)c1c(=O)c2cc(F)c(N3CCNCC3)cc2n2ccsc12

HCID3069130

5H-Thiazolo(3,2-a)quinoline-4-carboxylic acid, 7-fluoro-5-oxo-8-(1-piperazinyl)-

C16H14FN3O3S

PRODUCTS

生成物

结构：O=C(O)CCCC(=O)N1CCN(c2cc3c(cc2F)c(=O)c(C(=O)O)c2sccn23)CC1

HCID13850706

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-9f93a3bfc4cb4334acd728a5a207378b
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:25]1(=[O:32])[CH2:26][CH2:27][CH2:28][C:29](=[O:30])[O:31]1.[CH3:38][CH2:39][N:40]([CH2:41][CH3:42])[CH2:43][CH3:44].[CH3:49][C:50](=[O:51])[OH:52].[CH:45]([Cl:46])([Cl:47])[Cl:48].[F:1][c:2]1[cH:3][c:4]2[c:5](=[O:24])[c:6]([C:21](=[O:22])[OH:23])[c:7]3[n:8]([c:9]2[cH:10][c:11]1[N:12]1[CH2:13][CH2:14][NH:15][CH2:16][CH2:17]1)[cH:18][cH:19][s:20]3.[O:33]=[CH:34][N:35]([CH3:36])[CH3:37].[OH2:53]>>[F:1][c:2]1[cH:3][c:4]2[c:5](=[O:24])[c:6]([C:21](=[O:22])[OH:23])[c:7]3[n:8]([c:9]2[cH:10][c:11]1[N:12]1[CH2:13][CH2:14][N:15]([C:25]([CH2:26][CH2:27][CH2:28][C:29](=[O:30])[OH:31])=[O:32])[CH2:16][CH2:17]1)[cH:18][cH:19][s:20]3