O-Xylene → HCID 54712695, compound

HRID 2154263Notes

Reaction equation

HRID 2154263 reaction equation
[NH2:19][c:20]1[c:21](=[O:27])[cH:22][cH:23][cH:24][cH:25][cH:26]1.[OH:1][C:2]1=[C:3]([C:15]([O:17][CH3:16])=[O:18])[N:4]([CH3:14])[S:5](=[O:12])(=[O:13])[c:6]2[c:7]1[cH:8][cH:9][cH:10][cH:11]2.[c:28]1([CH3:29])[c:30]([CH3:31])[cH:32][cH:33][cH:34][cH:35]1>>[OH:1][C:2]1=[C:3]([C:15](=[O:17])[NH:19][c:20]2[c:21](=[O:27])[cH:22][cH:23][cH:24][cH:25][cH:26]2)[N:4]([CH3:14])[S:5](=[O:12])(=[O:13])[c:6]2[c:7]1[cH:8][cH:9][cH:10][cH:11]2

Participants

4

Reactant 3

HCID 7237O-XyleneHCID 226342-Aminocyclohepta-2,4,6-trien-1-oneHCID 54676532methyl 4-hydroxy-2-methyl-2H-1,2-benzothiazine-3-carboxylate 1,1-dioxide

Product 1

HCID 54712695HCID 54712695, compound

Sources & evidence

ORD record
ord-4e9e2512ab3d4a0f86e3e53c5684a0fe
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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