HRID1537309

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID702

Ethanol

C2H6O

HCID8471

Triethylamine

C6H15N

HCID24841

Hydrogen iodide

反应SMILES：NCCCCc1ccc(OCC(=O)N(CCO)CCO)cc1

HCID22054447

未命名化合物

HCID140444318

未命名化合物

PRODUCTS

产物

反应SMILES：NC(=NC(=O)c1nc(Cl)c(N)nc1N)NCCCCc1ccc(OCC(=O)N(CCO)CCO)cc1

HCID178512401

2-(4-{4-[N'-(3,5-diamino-6-chloropyrazine-2-carbonyl)guanidino]butyl}-phenoxy)-N,N-bis-(2-hydroxyethyl)acetamide

C22H31ClN8O5

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-83b3052e20b645ddbc0e2a839728c734
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

[CH3:40][CH2:41][N:42]([CH2:43][CH3:44])[CH2:45][CH3:46].[CH3:47][CH2:48][OH:49].[IH:1].[NH2:18][CH2:19][CH2:20][CH2:21][CH2:22][c:23]1[cH:24][cH:25][c:26]([O:27][CH2:28][C:29](=[O:30])[N:31]([CH2:32][CH2:33][OH:34])[CH2:35][CH2:36][OH:37])[cH:38][cH:39]1.[NH2:2][c:3]1[c:4]([C:11](=[O:12])[NH:13][C:14]([S:15][CH3:16])=[NH:17])[n:5][c:6]([Cl:10])[c:7]([NH2:9])[n:8]1>>[NH2:2][c:3]1[c:4]([C:11](=[O:12])[N:13]=[C:14]([NH2:17])[NH:18][CH2:19][CH2:20][CH2:21][CH2:22][c:23]2[cH:24][cH:25][c:26]([O:27][CH2:28][C:29](=[O:30])[N:31]([CH2:32][CH2:33][OH:34])[CH2:35][CH2:36][OH:37])[cH:38][cH:39]2)[n:5][c:6]([Cl:10])[c:7]([NH2:9])[n:8]1