Dimethylformamide → 3-(tert-Butyl-diphenyl-silanyloxy)-azetidine-1-carboxylic acid [5-(4-chloro-3-methanesulfonyl-phenyl)-4-methyl-thiazole-2-yl]amide

HRID 198898Notes

Reaction equation

HRID 198898 reaction equation
[C:39]([CH3:40])([CH3:41])([CH3:42])[Si:43]([O:44][CH:45]1[CH2:46][NH:47][CH2:48]1)([c:49]1[cH:50][cH:51][cH:52][cH:53][cH:54]1)[c:55]1[cH:56][cH:57][cH:58][cH:59][cH:60]1.[Cl:1][c:2]1[c:3]([S:17](=[O:18])(=[O:19])[CH3:20])[cH:4][c:5](-[c:8]2[c:9]([CH3:16])[n:10][c:11]([N:13]=[C:14]=[O:15])[s:12]2)[cH:6][cH:7]1.[Cl:21][c:22]1[cH:23][cH:24][c:25](-[c:26]2[s:27][c:28]([NH2:29])[n:30][c:31]2[CH3:32])[cH:33][c:34]1[S:35]([CH3:36])(=[O:37])=[O:38].[O:61]=[CH:62][N:63]([CH3:64])[CH3:65]>>[Cl:1][c:2]1[c:3]([S:17](=[O:18])(=[O:19])[CH3:20])[cH:4][c:5](-[c:8]2[c:9]([CH3:16])[n:10][c:11]([NH:13][C:14](=[O:15])[N:47]3[CH2:46][CH:45]([O:44][Si:43]([C:39]([CH3:40])([CH3:41])[CH3:42])([c:49]4[cH:50][cH:51][cH:52][cH:53][cH:54]4)[c:55]4[cH:56][cH:57][cH:58][cH:59][cH:60]4)[CH2:48]3)[s:12]2)[cH:6][cH:7]1

Participants

5

Reactant 4

HCID 6228DimethylformamideHCID 178425313-((Tert-butyldiphenylsilyl)oxy)azetidineHCID 578311165-[4-Chloro-3-(methylsulfonyl)phenyl]-4-methyl-1,3-thiazol-2-amineHCID 858616525-(4-Chloro-3-methanesulfonyl-phenyl)-2-isocyanato-4-methyl-thiazole

Product 1

HCID 865984283-(tert-Butyl-diphenyl-silanyloxy)-azetidine-1-carboxylic acid [5-(4-chloro-3-methanesulfonyl-phenyl)-4-methyl-thiazole-2-yl]amide

Sources & evidence

ORD record
ord-18792278670f4f2094fd4b068e7709e7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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