Dichloromethane → 3-cyclohexyl-2-[3-(2,6-difluorophenoxy)-5-oxo-2H-pyrrol-1-yl]-N-[1-(2-hydroxy-2-methylpropyl)pyrazol-3-yl]propanamide

HRID 317755Notes

Reaction equation

HRID 317755 reaction equation
[CH3:27][N:28]([CH3:29])[CH2:30][CH2:31][CH2:32][N:33]=[C:34]=[N:35][CH2:36][CH3:37].[CH:1]1([CH2:7][CH:8]([C:9](=[O:10])[OH:11])[N:12]2[C:13](=[O:26])[CH:14]=[C:15]([O:17][c:18]3[c:19]([F:25])[cH:20][cH:21][cH:22][c:23]3[F:24])[CH2:16]2)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1.[Cl:59][CH2:60][Cl:61].[NH2:48][c:49]1[n:50][n:51]([CH2:54][C:55]([CH3:56])([OH:57])[CH3:58])[cH:52][cH:53]1.[OH:38][n:39]1[c:40]2[cH:41][cH:42][cH:43][cH:44][c:45]2[n:46][n:47]1>>[CH:1]1([CH2:7][CH:8]([C:9](=[O:11])[NH:48][c:49]2[n:50][n:51]([CH2:54][C:55]([CH3:56])([OH:57])[CH3:58])[cH:52][cH:53]2)[N:12]2[C:13](=[O:26])[CH:14]=[C:15]([O:17][c:18]3[c:19]([F:25])[cH:20][cH:21][cH:22][c:23]3[F:24])[CH2:16]2)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1

Participants

6

Reactant 5

HCID 6344DichloromethaneHCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 757711-HydroxybenzotriazoleHCID 593449381-(3-amino-1H-pyrazol-1-yl)-2-methylpropan-2-olHCID 668954103-cyclohexyl-2-[3-(2,6-difluorophenoxy)-5-oxo-2H-pyrrol-1-yl]propanoic acid

Product 1

HCID 668999373-cyclohexyl-2-[3-(2,6-difluorophenoxy)-5-oxo-2H-pyrrol-1-yl]-N-[1-(2-hydroxy-2-methylpropyl)pyrazol-3-yl]propanamide

Sources & evidence

ORD record
ord-651e60d6c08940f591385ca830c78bab
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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