Dimethylformamide → 5-[3-(tert-Butyl-dimethyl-silanyloxy)-benzylcarbamoyl]-3-trifluoromethyl-thiophene-2-carboxylic acid methyl ester

HRID 111572Notes

Reaction equation

HRID 111572 reaction equation
[C:58]([CH3:59])([CH3:60])([CH3:61])[Si:62]([O:63][c:64]1[cH:65][c:66]([CH2:67][NH2:68])[cH:69][cH:70][cH:71]1)([CH3:72])[CH3:73].[CH3:17][CH2:18][N:19]([CH2:20][CH3:21])[CH2:22][CH3:23].[CH3:1][O:2][C:3](=[O:4])[c:5]1[s:6][c:7]([C:14](=[O:15])[OH:16])[cH:8][c:9]1[C:10]([F:11])([F:12])[F:13].[O:74]=[CH:75][N:76]([CH3:77])[CH3:78].[OH:48][n:49]1[c:50]2[c:51]([cH:52][cH:53][cH:54][cH:55]2)[n:56][n:57]1.[P-:24]([F:25])([F:26])([F:27])([F:28])([F:29])[F:30].[n:31]1([O:32][C:33]([N:34]([CH3:35])[CH3:36])=[N+:37]([CH3:38])[CH3:39])[c:40]2[cH:41][cH:42][cH:43][cH:44][c:45]2[n:46][n:47]1>>[CH3:1][O:2][C:3](=[O:4])[c:5]1[s:6][c:7]([C:14](=[O:16])[NH:68][CH2:67][c:66]2[cH:65][c:64]([O:63][Si:62]([C:58]([CH3:59])([CH3:60])[CH3:61])([CH3:72])[CH3:73])[cH:71][cH:70][cH:69]2)[cH:8][c:9]1[C:10]([F:11])([F:12])[F:13]

Participants

8

Reactant 7

HCID 6228DimethylformamideHCID 8471TriethylamineHCID 9886HexafluorophosphateHCID 757711-HydroxybenzotriazoleHCID 130500O-benzotriazol-1-yl-tetramethyluroniumHCID 222661693-[[(1,1-Dimethylethyl)dimethylsilyl]oxy]benzenemethanamineHCID 682266025-(Methoxycarbonyl)-4-(trifluoromethyl)thiophene-2-carboxylic acid

Product 1

HCID 682271015-[3-(tert-Butyl-dimethyl-silanyloxy)-benzylcarbamoyl]-3-trifluoromethyl-thiophene-2-carboxylic acid methyl ester

Sources & evidence

ORD record
ord-1c60981d01564069bba8432b9a36359a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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