Ethanol → tert-butyl 4-(2-(5,5-dimethyl-2,4-dioxoimidazolidin-1-yl)-4,5-dihydrothiazolo[4,5-d]benzo[b]oxepin-8-yl)-tetrahydropyridine-1(2H)-carboxylate

HRID 316980Notes

Reaction equation

HRID 316980 reaction equation
[CH3:1][C:2]1([CH3:36])[C:3](=[O:35])[NH:4][C:5](=[O:34])[N:6]1[c:7]1[s:8][c:9]2[c:10]([n:33]1)-[c:11]1[c:12]([cH:16][c:17]([C:20]3=[CH:21][CH2:22][N:23]([C:26](=[O:27])[O:28][C:29]([CH3:30])([CH3:31])[CH3:32])[CH2:24][CH2:25]3)[cH:18][cH:19]1)[O:13][CH2:14][CH2:15]2.[CH3:37][CH2:38][OH:39]>>[CH3:1][C:2]1([CH3:36])[C:3](=[O:35])[NH:4][C:5](=[O:34])[N:6]1[c:7]1[s:8][c:9]2[c:10]([n:33]1)-[c:11]1[c:12]([cH:16][c:17]([CH:20]3[CH2:21][CH2:22][N:23]([C:26](=[O:27])[O:28][C:29]([CH3:30])([CH3:31])[CH3:32])[CH2:24][CH2:25]3)[cH:18][cH:19]1)[O:13][CH2:14][CH2:15]2

Participants

3

Reactant 2

HCID 702EthanolHCID 58203717tert-butyl 4-(2-(5,5-dimethyl-2,4-dioxoimidazolidin-1-yl)-4,5-dihydrothiazolo[4,5-d]benzo[b]oxepin-8-yl)-5,6-dihydropyridine-1(2H)-carboxylate

Product 1

HCID 58204137tert-butyl 4-(2-(5,5-dimethyl-2,4-dioxoimidazolidin-1-yl)-4,5-dihydrothiazolo[4,5-d]benzo[b]oxepin-8-yl)-tetrahydropyridine-1(2H)-carboxylate

Sources & evidence

ORD record
ord-44dd98d036ed4d49b6188a390543c9c6
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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