Hydrochloric Acid → 1-(4-((2-(3-Phenoxy-5-(thieno[3,2-b]pyridin-7-ylthio)pyridin-2-ylamino)thiazol-4-yl)methyl)piperidin-1-yl)ethanone

HRID 159427Notes

Reaction equation

HRID 159427 reaction equation
[CH2:53]1[O:54][CH2:55][CH2:56][CH2:57]1.[CH3:1][C:2](=[O:3])[O:4][C:5](=[O:6])[CH3:7].[CH3:46][CH2:47][N:48]([CH2:49][CH3:50])[CH2:51][CH3:52].[ClH:8].[ClH:9].[O:10]([c:11]1[cH:12][cH:13][cH:14][cH:15][cH:16]1)[c:17]1[c:18]([NH:33][c:34]2[s:35][cH:36][c:37]([CH2:39][CH:40]3[CH2:41][CH2:42][NH:43][CH2:44][CH2:45]3)[n:38]2)[n:19][cH:20][c:21]([S:23][c:24]2[c:25]3[c:26]([n:27][cH:28][cH:29]2)[cH:30][cH:31][s:32]3)[cH:22]1>>[CH3:1][C:2](=[O:3])[N:43]1[CH2:42][CH2:41][CH:40]([CH2:39][c:37]2[cH:36][s:35][c:34]([NH:33][c:18]3[c:17]([O:10][c:11]4[cH:12][cH:13][cH:14][cH:15][cH:16]4)[cH:22][c:21]([S:23][c:24]4[c:25]5[c:26]([n:27][cH:28][cH:29]4)[cH:30][cH:31][s:32]5)[cH:20][n:19]3)[n:38]2)[CH2:45][CH2:44]1

Participants

6

Reactant 5

HCID 313Hydrochloric Acid2×HCID 7918Acetic AnhydrideHCID 8028TetrahydrofuranHCID 8471TriethylamineHCID 57742599N-(3-phenoxy-5-thieno[3,2-b]pyridin-7-ylsulfanyl-2-pyridinyl)-4-(piperidin-4-ylmethyl)-1,3-thiazol-2-amine

Product 1

HCID 577429321-(4-((2-(3-Phenoxy-5-(thieno[3,2-b]pyridin-7-ylthio)pyridin-2-ylamino)thiazol-4-yl)methyl)piperidin-1-yl)ethanone

Sources & evidence

ORD record
ord-825d28211bca44c9a0fc1fc92ba639ef
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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