Dichloromethane → 2-fluoro-1-[2-(2-methoxyethyl)-4-[2-(trifluoromethyl)-10H-[1,3]thiazolo[5,4-b][1,5]benzodiazepin-4-yl]piperazin-1-yl]ethanone

HRID 1141606Notes

Reaction equation

HRID 1141606 reaction equation
[CH3:6][O:7][CH2:8][CH2:9][CH:10]1[CH2:11][N:12]([C:16]2=[N:17][c:18]3[c:19]([cH:30][cH:31][cH:32][cH:33]3)[NH:20][c:21]3[s:22][c:23]([C:26]([F:27])([F:28])[F:29])[n:24][c:25]32)[CH2:13][CH2:14][NH:15]1.[CH:34]([N:35]([CH:36]([CH3:37])[CH3:38])[CH2:39][CH3:40])([CH3:41])[CH3:42].[Cl:43][CH2:44][Cl:45].[F:1][CH2:2][C:3](=[O:4])[Cl:5]>>[F:1][CH2:2][C:3](=[O:4])[N:15]1[CH:10]([CH2:9][CH2:8][O:7][CH3:6])[CH2:11][N:12]([C:16]2=[N:17][c:18]3[c:19]([cH:30][cH:31][cH:32][cH:33]3)[NH:20][c:21]3[s:22][c:23]([C:26]([F:27])([F:28])[F:29])[n:24][c:25]32)[CH2:13][CH2:14]1

Participants

5

Reactant 4

HCID 6344DichloromethaneHCID 9663Fluoroacetyl chlorideHCID 81531DiisopropylethylamineHCID 136384216HCID 136384216, compound

Product 1

HCID 1363948752-fluoro-1-[2-(2-methoxyethyl)-4-[2-(trifluoromethyl)-10H-[1,3]thiazolo[5,4-b][1,5]benzodiazepin-4-yl]piperazin-1-yl]ethanone

Sources & evidence

ORD record
ord-dfd8308c99e44374bb23a574f05505c9
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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