HRID2343595

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID11

1,2-Dichloroethane

C2H4Cl2

HCID888

Magnesium cation

Mg+2

HCID923

Sodium ion

Na+

HCID1117

Sulfate

O4S-2

HCID2724942

未命名化合物

反应SMILES：CC(C)NCC1CC(n2ccc3c(N)ncnc32)C2OC(C)(C)OC12

HCID67817710

未命名化合物

反应SMILES：CC(C)(C)c1ccc2c(c1)nc(CC1CC(C=O)C1)n2COCC[Si](C)(C)C

HCID86666124

未命名化合物

PRODUCTS

产物

反应SMILES：CC(C)N(CC1CC(Cc2nc3cc(C(C)(C)C)ccc3n2COCC[Si](C)(C)C)C1)CC1CC(n2ccc3c(N)ncnc32)C2OC(C)(C)OC12

HCID178457039

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-d111690a68f24827ab10dc11fac23cf4
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应SMILES

[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7]2[c:8]([n:9]([CH2:19][O:20][CH2:21][CH2:22][Si:23]([CH3:24])([CH3:25])[CH3:26])[c:10]([CH2:12][CH:13]3[CH2:14][CH:15]([CH:17]=[O:18])[CH2:16]3)[n:11]2)[cH:27][cH:28]1.[C:60]([O:61][BH-:62]([O:63][C:64](=[O:65])[CH3:66])[O:67][C:68](=[O:69])[CH3:70])(=[O:71])[CH3:72].[CH3:29][C:30]1([CH3:53])[O:31][CH:32]2[CH:33]([O:34]1)[CH:35]([CH2:48][NH:49][CH:50]([CH3:51])[CH3:52])[CH2:36][CH:37]2[n:38]1[cH:39][cH:40][c:41]2[c:42]1[n:43][cH:44][n:45][c:46]2[NH2:47].[Cl:74][CH2:75][CH2:76][Cl:77].[Mg+2:54].[Na+:73].[O-:55][S:56](=[O:57])(=[O:58])[O-:59]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7]2[c:8]([n:9]([CH2:19][O:20][CH2:21][CH2:22][Si:23]([CH3:24])([CH3:25])[CH3:26])[c:10]([CH2:12][CH:13]3[CH2:14][CH:15]([CH2:17][N:49]([CH2:48][CH:35]4[CH:33]5[CH:32]([O:31][C:30]([CH3:29])([CH3:53])[O:34]5)[CH:37]([n:38]5[cH:39][cH:40][c:41]6[c:42]5[n:43][cH:44][n:45][c:46]6[NH2:47])[CH2:36]4)[CH:50]([CH3:51])[CH3:52])[CH2:16]3)[n:11]2)[cH:27][cH:28]1