1,4-Dioxane → HCID 18507405, compound

HRID 2157328Notes

Reaction equation

HRID 2157328 reaction equation
[NH2:1][c:2]1[n:3][c:4](-[c:13]2[s:14][cH:15][cH:16][cH:17]2)[c:5]([C:11]#[N:12])[c:6]([S:8]([CH3:9])=[O:10])[n:7]1.[O:28]1[CH2:29][CH2:30][O:31][CH2:32][CH2:33]1.[c:18]1([NH:24][CH2:25][CH2:26][NH2:27])[cH:19][cH:20][cH:21][cH:22][cH:23]1>>[NH2:1][c:2]1[n:3][c:4](-[c:13]2[s:14][cH:15][cH:16][cH:17]2)[c:5]([C:11]#[N:12])[c:6]([NH:27][CH2:26][CH2:25][NH:24][c:18]2[cH:19][cH:20][cH:21][cH:22][cH:23]2)[n:7]1

Participants

4

Reactant 3

HCID 312751,4-DioxaneHCID 742701,2-Ethanediamine, N1-phenyl-HCID 18507414HCID 18507414, compound

Product 1

HCID 18507405HCID 18507405, compound

Sources & evidence

ORD record
ord-cb56c5dbe258477a90274dcaa951a666
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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