Acetic Acid → HCID 178453563, compound

HRID 2124591

Reaction equation

HRID 2124591 reaction equation
[CH3:42][C:43](=[O:44])[OH:45].[F:1][c:2]1[cH:3][c:4]([NH2:26])[cH:5][cH:6][c:7]1-[c:8]1[s:9][c:10]2[n:11][c:12]([C:17]3([c:20]4[cH:21][cH:22][cH:23][cH:24][cH:25]4)[CH2:18][CH2:19]3)[cH:13][cH:14][c:15]2[n:16]1.[O:27]=[C:28]1[O:29][C:30](=[O:41])[CH2:31][CH:32]1[NH:33][C:34]([O:35][C:36]([CH3:37])([CH3:38])[CH3:39])=[O:40].[cH:46]1[cH:47][cH:48][cH:49][cH:50][cH:51]1>>[F:1][c:2]1[cH:3][c:4]([NH:26][C:28](=[O:27])[CH:32]([CH2:31][C:30](=[O:29])[OH:41])[NH:33][C:34]([O:35][C:36]([CH3:37])([CH3:38])[CH3:39])=[O:40])[cH:5][cH:6][c:7]1-[c:8]1[s:9][c:10]2[n:11][c:12]([C:17]3([c:20]4[cH:21][cH:22][cH:23][cH:24][cH:25]4)[CH2:18][CH2:19]3)[cH:13][cH:14][c:15]2[n:16]1

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 241BenzeneHCID 37577793-(Boc-amino)dihydrofuran-2,5-dioneHCID 574030523-Fluoro-4-(5-(1-phenylcyclopropyl)thiazolo[5,4-b]pyridin-2-yl)benzenamine

Product 1

HCID 178453563HCID 178453563, compound

Sources & evidence

ORD record
ord-802a1665421c4fda8e3568cfc1076c30
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Linked notes

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