O-Xylene → 7-Hydroxy-8-nitro-2H-thiazolo[3,2-A]pyridin-5(3H)-one

HRID 185327

Reaction equation

HRID 185327 reaction equation
[Cl:25][c:26]1[cH:27][c:28]([Cl:29])[cH:30][c:31]([Cl:32])[c:33]1[O:34][C:35](=[O:36])[CH2:37][C:38]([O:39][c:40]1[c:41]([Cl:42])[cH:43][c:44]([Cl:45])[cH:46][c:47]1[Cl:48])=[O:49].[N+:16]([CH:17]=[C:18]1[NH:19][CH2:20][CH2:21][S:22]1)([O-:23])=[O:24].[OH:1][c:2]1[c:3]([N+:13](=[O:14])[O-:15])[c:4]2[n:5]([c:6](=[O:9])[c:7]1[CH3:8])[CH2:10][CH2:11][S:12]2.[c:50]1([CH3:51])[c:52]([CH3:53])[cH:54][cH:55][cH:56][cH:57]1>>[OH:1][c:2]1[c:3]([N+:13](=[O:14])[O-:15])[c:4]2[n:5]([c:6](=[O:9])[cH:7]1)[CH2:10][CH2:11][S:12]2

Participants

5

Reactant 4

HCID 7237O-XyleneHCID 2783450Bis(2,4,6-trichlorophenyl) propanedioateHCID 38355832-Nitromethylene-thiazolidineHCID 583805737-Hydroxy-6-methyl-8-nitro-2H-thiazolo[3,2-A]pyridin-5(3H)-one

Product 1

HCID 583805817-Hydroxy-8-nitro-2H-thiazolo[3,2-A]pyridin-5(3H)-one

Sources & evidence

ORD record
ord-e63c93458bac4bfdabbe5cc6759510d8
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Linked notes

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