Dimethylacetamide → HCID 178521188, compound

HRID 2319098Notes

Reaction equation

HRID 2319098 reaction equation
[C:1]([n:2]1[cH:3][cH:4][n:5][cH:6]1)([n:7]1[cH:8][cH:9][n:10][cH:11]1)=[O:12].[CH3:70][N:71]([CH3:72])[C:73](=[O:74])[CH3:75].[F:24][C:25]([F:26])([F:27])[C:28]([O-:29])=[O:30].[NH2:31][CH:32]1[CH:33]2[S:34][CH2:35][C:36]([CH:44]=[C:45]3[C:46](=[O:69])[N:47]([CH2:50][c:51]4[cH:52][cH:53][n+:54]([CH2:57][C:58]([NH:59][c:60]5[cH:61][c:62]([F:67])[c:63]([OH:66])[cH:64][cH:65]5)=[O:68])[cH:55][cH:56]4)[CH2:48][CH2:49]3)=[C:37]([C:41](=[O:42])[OH:43])[N:38]2[C:39]1=[O:40].[c:13]1([S:19][CH2:20][C:21](=[O:22])[OH:23])[cH:14][cH:15][cH:16][cH:17][cH:18]1>>[c:13]1([S:19][CH2:20][C:21](=[O:23])[NH:31][CH:32]2[CH:33]3[S:34][CH2:35][C:36]([CH:44]=[C:45]4[C:46](=[O:69])[N:47]([CH2:50][c:51]5[cH:52][cH:53][n+:54]([CH2:57][C:58]([NH:59][c:60]6[cH:61][c:62]([F:67])[c:63]([OH:66])[cH:64][cH:65]6)=[O:68])[cH:55][cH:56]5)[CH2:48][CH2:49]4)=[C:37]([C:41](=[O:42])[O-:43])[N:38]3[C:39]2=[O:40])[cH:14][cH:15][cH:16][cH:17][cH:18]1

Participants

6

Reactant 5

HCID 31374DimethylacetamideHCID 59541(Phenylthio)acetic acidHCID 682631,1'-CarbonyldiimidazoleHCID 84468TrifluoroacetateHCID 178508096HCID 178508096, compound

Product 1

HCID 178521188HCID 178521188, compound

Sources & evidence

ORD record
ord-44897d9e10ba43fbacdd88b64e271823
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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