Hydroxide → HCID 59511427, compound

HRID 1206142Notes

Reaction equation

HRID 1206142 reaction equation
[CH2:55]1[O:56][CH2:57][CH2:58][CH2:59]1.[CH3:61][CH2:62][O:63][C:64]([CH3:65])=[O:66].[F:1][C:2]([F:3])([F:4])[C:50]([N:5]([CH2:6][c:7]1[cH:8][c:9]([NH:13][c:14]2[n:15][cH:16][cH:17][c:18](-[c:20]3[c:21](-[c:29]4[cH:30][c:31]([NH:35][C:36]([CH2:37][c:38]5[s:39][cH:40][cH:41][cH:42]5)=[O:43])[cH:32][cH:33][cH:34]4)[n:22][n:23]4[c:24]3[cH:25][cH:26][cH:27][cH:28]4)[n:19]2)[cH:10][cH:11][cH:12]1)[CH2:44][CH2:45][S:46](=[O:47])(=[O:48])[CH3:49])=[O:51].[Li+:53].[OH-:52].[OH2:54].[OH2:60]>>[NH:5]([CH2:6][c:7]1[cH:8][c:9]([NH:13][c:14]2[n:15][cH:16][cH:17][c:18](-[c:20]3[c:21](-[c:29]4[cH:30][c:31]([NH:35][C:36]([CH2:37][c:38]5[s:39][cH:40][cH:41][cH:42]5)=[O:43])[cH:32][cH:33][cH:34]4)[n:22][n:23]4[c:24]3[cH:25][cH:26][cH:27][cH:28]4)[n:19]2)[cH:10][cH:11][cH:12]1)[CH2:44][CH2:45][S:46](=[O:47])(=[O:48])[CH3:49]

Participants

7

Reactant 6

HCID 961HydroxideHCID 962Water2×HCID 8028TetrahydrofuranHCID 8857Ethyl AcetateHCID 28486Lithium ionHCID 577372392,2,2-Trifluoro-N-[2-(methylsulfonyl)ethyl]-N-[(3-{[4-(2-{3-[(2-thienylacetyl)amino]phenyl}pyrazolo[1,5-a]pyridin-3-yl)-2-pyrimidinyl]amino}phenyl)methyl]acetamide

Product 1

HCID 59511427HCID 59511427, compound

Sources & evidence

ORD record
ord-a2845f90a25e4be48726363b92487ee1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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