Bromide ion → Methyl 4-[2-[2-acetamido-5-[(4-methylsulfanylphenyl)methyl]-1,3-thiazol-4-yl]ethenyl]benzoate

HRID 317036Notes

Reaction equation

HRID 317036 reaction equation
[Br-:1].[CH3:2][O:3][C:4](=[O:5])[c:6]1[cH:7][cH:8][c:9]([CH2:10][P+:11]([c:12]2[cH:13][cH:14][cH:15][cH:16][cH:17]2)([c:18]2[cH:19][cH:20][cH:21][cH:22][cH:23]2)[c:24]2[cH:25][cH:26][cH:27][cH:28][cH:29]2)[cH:30][cH:31]1.[CH3:32][C:33]([CH3:34])([O-:35])[CH3:36].[CH:38](=[O:39])[c:40]1[n:41][c:42]([NH:54][C:55]([CH3:56])=[O:57])[s:43][c:44]1[CH2:45][c:46]1[cH:47][cH:48][c:49]([S:52][CH3:53])[cH:50][cH:51]1.[K+:37].[O:58]=[CH:59][N:60]([CH3:61])[CH3:62]>>[CH3:2][O:3][C:4](=[O:5])[c:6]1[cH:7][cH:8][c:9]([CH:10]=[CH:38][c:40]2[n:41][c:42]([NH:54][C:55]([CH3:56])=[O:57])[s:43][c:44]2[CH2:45][c:46]2[cH:47][cH:48][c:49]([S:52][CH3:53])[cH:50][cH:51]2)[cH:30][cH:31]1

Participants

7

Reactant 6

HCID 259Bromide ionHCID 813Potassium CationHCID 6228DimethylformamideHCID 2764258(4-Methoxycarbonylphenyl)methyl-triphenylphosphaniumHCID 45749132-Methylpropan-2-olateHCID 21914849N-{4-formyl-5-[4-(methylthio)benzyl]-1,3-thiazol-2-yl}acetamide

Product 1

HCID 91339022Methyl 4-[2-[2-acetamido-5-[(4-methylsulfanylphenyl)methyl]-1,3-thiazol-4-yl]ethenyl]benzoate

Sources & evidence

ORD record
ord-89108d61fae44f1cb0e7327c60739dd5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

Loading…