Hydrochloric Acid → 6-[2-[3-(difluoromethoxy)-2-(3-methylbutoxy)phenyl]ethenyl]-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]imidazo[2,1-b][1,3]thiazole-5-carboxamide

HRID 301428Notes

Reaction equation

HRID 301428 reaction equation
[CH2:61]1[O:62][CH2:63][CH2:64][CH2:65]1.[CH3:40][CH2:41][N:42]=[C:43]=[N:44][CH2:45][CH2:46][CH2:47][N:48]([CH3:49])[CH3:50].[CH3:52][N:53]([c:54]1[cH:55][cH:56][n:57][cH:58][cH:59]1)[CH3:60].[ClH:51].[F:1][CH:2]([O:3][c:4]1[c:5]([O:23][CH2:24][CH2:25][CH:26]([CH3:27])[CH3:28])[c:6]([CH:10]=[CH:11][c:12]2[n:13][c:14]3[s:15][cH:16][cH:17][n:18]3[c:19]2[C:20](=[O:21])[OH:22])[cH:7][cH:8][cH:9]1)[F:29].[F:30][C:31]([c:32]1[n:33][c:34]([NH2:37])[s:35][cH:36]1)([F:38])[F:39].[O:66]=[CH:67][N:68]([CH3:69])[CH3:70]>>[F:1][CH:2]([O:3][c:4]1[c:5]([O:23][CH2:24][CH2:25][CH:26]([CH3:27])[CH3:28])[c:6]([CH:10]=[CH:11][c:12]2[n:13][c:14]3[s:15][cH:16][cH:17][n:18]3[c:19]2[C:20](=[O:22])[NH:37][c:34]2[n:33][c:32]([C:31]([F:30])([F:38])[F:39])[cH:36][s:35]2)[cH:7][cH:8][cH:9]1)[F:29]

Participants

8

Reactant 7

HCID 313Hydrochloric AcidHCID 6228DimethylformamideHCID 8028TetrahydrofuranHCID 142844-(Dimethylamino)pyridineHCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 12014172-Thiazolamine, 4-(trifluoromethyl)-HCID 684062826-[2-[3-(Difluoromethoxy)-2-(3-methylbutoxy)phenyl]ethenyl]imidazo[2,1-b][1,3]thiazole-5-carboxylic acid

Product 1

HCID 752158566-[2-[3-(difluoromethoxy)-2-(3-methylbutoxy)phenyl]ethenyl]-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]imidazo[2,1-b][1,3]thiazole-5-carboxamide

Sources & evidence

ORD record
ord-e541ad6cf711485e902b192594e51cca
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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