Hydrochloric Acid → Hydrochloric Acid

HRID 103891Notes

Reaction equation

HRID 103891 reaction equation
[C:1]([O:2][CH2:3][CH3:4])(=[O:5])[CH3:6].[CH3:41][CH2:42][O:43][C:44](=[O:45])[CH3:46].[CH3:8][S:9](=[O:10])(=[O:11])[c:12]1[cH:13][c:14]2[c:18]([cH:19][cH:20]1)[N:17]([c:21]1[cH:22][c:23]([O:27][CH:28]3[CH2:29][CH2:30][N:31]([C:34]([O:35][C:36]([CH3:37])([CH3:38])[CH3:39])=[O:40])[CH2:32][CH2:33]3)[n:24][cH:25][n:26]1)[CH2:16][CH2:15]2.[ClH:7]>>[CH3:8][S:9](=[O:10])(=[O:11])[c:12]1[cH:13][c:14]2[c:18]([cH:19][cH:20]1)[N:17]([c:21]1[cH:22][c:23]([O:27][CH:28]3[CH2:29][CH2:30][NH:31][CH2:32][CH2:33]3)[n:24][cH:25][n:26]1)[CH2:16][CH2:15]2.[ClH:7]

Participants

5

Reactant 3

HCID 313Hydrochloric AcidHCID 8857Ethyl Acetate2×HCID 25242414Tert-butyl 4-((6-(5-(methylsulfonyl)indolin-1-yl)pyrimidin-4-yl)oxy)piperidine-1-carboxylate

Product 2

HCID 313Hydrochloric AcidHCID 667096685-(Methylsulfonyl)-1-(6-(piperidin-4-yloxy)pyrimidin-4-yl)indoline

Sources & evidence

ORD record
ord-d0011dc824c544f9b4540129447e75fc
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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