Dimethylformamide → N-[5-(4-Methanesulfonyl-3-trifluoromethyl-phenyl)-4-methyl-thiazol-2-yl]-2-methoxy-acetamide

HRID 1132706Notes

Reaction equation

HRID 1132706 reaction equation
[CH3:1][S:2](=[O:3])(=[O:4])[c:5]1[c:6]([C:18]([F:19])([F:20])[F:21])[cH:7][c:8](-[c:11]2[c:12]([CH3:17])[n:13][c:14]([NH2:16])[s:15]2)[cH:9][cH:10]1.[CH3:46][O:47][CH2:48][C:49](=[O:50])[OH:51].[CH:52]([N:53]([CH2:54][CH3:55])[CH:56]([CH3:57])[CH3:58])([CH3:59])[CH3:60].[O:61]=[CH:62][N:63]([CH3:64])[CH3:65].[P-:22]([F:23])([F:24])([F:25])([F:26])([F:27])[F:28].[n:29]1([O:30][C:31]([N:32]([CH3:33])[CH3:34])=[N+:35]([CH3:36])[CH3:37])[c:38]2[n:39][cH:40][cH:41][cH:42][c:43]2[n:44][n:45]1>>[CH3:1][S:2](=[O:3])(=[O:4])[c:5]1[c:6]([C:18]([F:19])([F:20])[F:21])[cH:7][c:8](-[c:11]2[c:12]([CH3:17])[n:13][c:14]([NH:16][C:49]([CH2:48][O:47][CH3:46])=[O:50])[s:15]2)[cH:9][cH:10]1

Participants

7

Reactant 6

HCID 6228DimethylformamideHCID 9886HexafluorophosphateHCID 12251Methoxyacetic AcidHCID 81531DiisopropylethylamineHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 574737494-Methyl-5-(4-(methylsulfonyl)-3-(trifluoromethyl)phenyl)thiazol-2-amine

Product 1

HCID 86598425N-[5-(4-Methanesulfonyl-3-trifluoromethyl-phenyl)-4-methyl-thiazol-2-yl]-2-methoxy-acetamide

Sources & evidence

ORD record
ord-8a6b8e35c84e448bafc3a049ff1d0e03
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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