HRID206870

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID88333

1,1'-(3-Bromopropylidene)bisbenzene

C15H15Br

结构：O=C1NCN(c2ccccc2)C12CCN(C1CCCCCCCCC1)CC2

HCID9842289

未命名化合物

PRODUCTS

生成物

HCID313

Hydrochloric Acid

ClH

结构：O=C1N(CCC(c2ccccc2)c2ccccc2)CN(c2ccccc2)C12CCN(C1CCCCCCCCC1)CC2

HCID18801225

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d9a1025d7db34282acc60dd1cc8b16ff
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

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