Acetate → HCID 85146248, compound

HRID 174919Notes

Reaction equation

HRID 174919 reaction equation
[CH3:25][C:26](=[O:27])[O-:28].[CH3:29][C:30]([O:31][C:32](=[O:33])[CH3:34])=[O:35].[Cl:1][c:2]1[c:3](-[c:8]2[cH:9][c:10]([C:14]([CH3:15])=[O:16])[cH:11][cH:12][cH:13]2)[cH:4][cH:5][cH:6][cH:7]1.[Na+:24].[S:17]1[C:18](=[O:23])[NH:19][C:20](=[O:22])[CH2:21]1.[c:36]1([CH3:37])[c:38]([CH3:39])[cH:40][cH:41][cH:42][cH:43]1>>[Cl:1][c:2]1[c:3](-[c:8]2[cH:9][c:10]([C:14]([CH3:15])=[C:21]3[S:17][C:18](=[O:23])[NH:19][C:20]3=[O:22])[cH:11][cH:12][cH:13]2)[cH:4][cH:5][cH:6][cH:7]1

Participants

7

Reactant 6

HCID 175AcetateHCID 923Sodium ionHCID 5437ThiazolidinedioneHCID 7237O-XyleneHCID 7918Acetic AnhydrideHCID 51285771-(2′-Chloro[1,1′-biphenyl]-3-yl)ethanone

Product 1

HCID 85146248HCID 85146248, compound

Sources & evidence

ORD record
ord-39beb371ba724f718a15c8b07541a8c0
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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