1,4-Dioxane → HCID 10299501, compound

HRID 676340Notes

Reaction equation

HRID 676340 reaction equation
[O:1]=[C:2]1[S:3][C:4](=[CH:8][c:9]2[cH:10][cH:11][c:12](-[c:15]3[cH:16][c:17]([CH2:21][N:22]([C:23]([CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH2:31][CH3:32])=[O:33])[CH3:34])[cH:18][cH:19][cH:20]3)[cH:13][cH:14]2)[C:5](=[O:7])[NH:6]1.[O:35]1[CH2:36][CH2:37][O:38][CH2:39][CH2:40]1>>[O:1]=[C:2]1[S:3][CH:4]([CH2:8][c:9]2[cH:10][cH:11][c:12](-[c:15]3[cH:16][c:17]([CH2:21][N:22]([C:23]([CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH2:31][CH3:32])=[O:33])[CH3:34])[cH:18][cH:19][cH:20]3)[cH:13][cH:14]2)[C:5](=[O:7])[NH:6]1

Participants

3

Reactant 2

HCID 312751,4-DioxaneHCID 86591263HCID 86591263, compound

Product 1

HCID 10299501HCID 10299501, compound

Sources & evidence

ORD record
ord-1471c94e9ffb4fceafb04da16b972c1a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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