HRID1546229

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID260

Hydrogen Bromide

BrH

2 次

HCID6342

Acetonitrile

C2H3N

HCID81184

1,8-Diazabicyclo[5.4.0]undec-7-ene

C9H16N2

结构：O=C(O)c1cn(C2CC2)c2c(F)c(F)c(F)cc2c1=O

HCID535414

1-CYCLOPROPYL-6,7,8-TRIFLUORO-1,4-DIHYDRO-4-OXOQUINOLINE-3-CARBOXYLIC ACID

C13H8F3NO3

HCID15192253

1,2,3,4,5,6-Hexahydropyrrolo[3,4-c]pyrrole

C6H10N2

PRODUCTS

生成物

结构：O=C(O)c1cn(C2CC2)c2c(F)c(N3CC4=C(CNC4)C3)c(F)cc2c1=O

HCID9864305

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-1e92a7849e4f4ae28a73bd7fef475cf4
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

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