Hydrochloric Acid → N-[3-(2-benzamido-4,4a,5,7-tetrahydrofuro[3,4-d][1,3]thiazin-7a-yl)-4-fluorophenyl]-5-fluoropyridine-2-carboxamide

HRID 2338288Notes

Reaction equation

HRID 2338288 reaction equation
[CH3:49][N:50]([CH3:51])[CH2:52][CH2:53][CH2:54][N:55]=[C:56]=[N:57][CH2:58][CH3:59].[Cl:62][CH2:63][Cl:64].[ClH:48].[F:27][c:28]1[cH:29][cH:30][c:31]([C:34](=[O:35])[OH:36])[n:32][cH:33]1.[NH2:1][c:2]1[cH:3][cH:4][c:5]([F:26])[c:6]([C:8]23[N:9]=[C:10]([NH:17][C:18]([c:19]4[cH:20][cH:21][cH:22][cH:23][cH:24]4)=[O:25])[S:11][CH2:12][CH:13]2[CH2:14][O:15][CH2:16]3)[cH:7]1.[Na+:61].[O:65]=[CH:66][N:67]([CH3:68])[CH3:69].[OH-:60].[OH2:37].[OH:38][n:39]1[c:40]2[cH:41][cH:42][cH:43][cH:44][c:45]2[n:46][n:47]1>>[NH:1]([c:2]1[cH:3][cH:4][c:5]([F:26])[c:6]([C:8]23[N:9]=[C:10]([NH:17][C:18]([c:19]4[cH:20][cH:21][cH:22][cH:23][cH:24]4)=[O:25])[S:11][CH2:12][CH:13]2[CH2:14][O:15][CH2:16]3)[cH:7]1)[C:34]([c:31]1[cH:30][cH:29][c:28]([F:27])[cH:33][n:32]1)=[O:35]

Participants

11

Reactant 10

HCID 313Hydrochloric AcidHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 6228DimethylformamideHCID 6344DichloromethaneHCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 757711-HydroxybenzotriazoleHCID 27628765-fluoropyridine-2-carboxylic AcidHCID 76550580N-[7a-(5-amino-2-fluorophenyl)-4,4a,5,7-tetrahydrofuro[3,4-d][1,3]thiazin-2-yl]benzamide

Product 1

HCID 76550584N-[3-(2-benzamido-4,4a,5,7-tetrahydrofuro[3,4-d][1,3]thiazin-7a-yl)-4-fluorophenyl]-5-fluoropyridine-2-carboxamide

Sources & evidence

ORD record
ord-472db50d1c5e4db09fb4b3f0e87b7b22
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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