HRID1225579

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID259

Bromide

Br-

HCID813

Potassium cation

K+

HCID962

Water

H2O

HCID8028

Tetrahydrofuran

C4H8O

HCID12341

Ethane, 1-chloro-2-ethoxy- (9CI)

C4H9ClO

HCID16028

Tetrabutylammonium

C16H36N+

HCID3280088

未命名化合物

结构：c1ccc(CN2CCC(Nc3nc4ccccc4[nH]3)CC2)cc1

HCID16640950

N-(1-Benzylpiperidin-4-yl)-1H-benzimidazol-2-amine

C19H22N4

PRODUCTS

生成物

结构：CCOCCn1c(NC2CCN(Cc3ccccc3)CC2)nc2ccccc21

HCID13808349

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-8b3f2bea6b2c4a87b59283fd452198ae
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

[Br-:45].[CH2:39]([O:40][CH2:41][CH2:42][Cl:43])[CH3:44].[CH3:29][Si:30]([N-:31][Si:32]([CH3:33])([CH3:34])[CH3:35])([CH3:36])[CH3:37].[CH3:46][CH2:47][CH2:48][CH2:49][N+:50]([CH2:51][CH2:52][CH2:53][CH3:54])([CH2:55][CH2:56][CH2:57][CH3:58])[CH2:59][CH2:60][CH2:61][CH3:62].[K+:38].[O:24]1[CH2:25][CH2:26][CH2:27][CH2:28]1.[OH2:63].[nH:1]1[c:2]([NH:10][CH:11]2[CH2:12][CH2:13][N:14]([CH2:17][c:18]3[cH:19][cH:20][cH:21][cH:22][cH:23]3)[CH2:15][CH2:16]2)[n:3][c:4]2[c:5]1[cH:6][cH:7][cH:8][cH:9]2>>[n:1]1([CH2:27][CH2:28][O:24][CH2:25][CH3:26])[c:2]([NH:10][CH:11]2[CH2:12][CH2:13][N:14]([CH2:17][c:18]3[cH:19][cH:20][cH:21][cH:22][cH:23]3)[CH2:15][CH2:16]2)[n:3][c:4]2[c:5]1[cH:6][cH:7][cH:8][cH:9]2