Methanol → 2-[4-[(3,4-dichloro-5-methyl-1H-pyrrole-2-carbonyl)amino]-3-methoxypiperidin-1-yl]-4-[5-(4-methylpiperazin-1-yl)pyrazin-2-yl]-1,3-thiazole-5-carboxylic acid
Reaction equation
[CH3:45][OH:46].[Cl:1][c:2]1[c:3]([C:9](=[O:10])[NH:11][CH:12]2[CH:13]([O:41][CH3:42])[CH2:14][N:15]([c:18]3[s:19][c:20]([C:36](=[O:37])[O:38][CH2:39][CH3:40])[c:21](-[c:23]4[n:24][cH:25][c:26]([N:29]5[CH2:30][CH2:31][N:32]([CH3:35])[CH2:33][CH2:34]5)[n:27][cH:28]4)[n:22]3)[CH2:16][CH2:17]2)[nH:4][c:5]([CH3:8])[c:6]1[Cl:7].[Na+:44].[OH-:43]>>[Cl:1][c:2]1[c:3]([C:9](=[O:10])[NH:11][CH:12]2[CH:13]([O:41][CH3:42])[CH2:14][N:15]([c:18]3[s:19][c:20]([C:36](=[O:37])[OH:38])[c:21](-[c:23]4[n:24][cH:25][c:26]([N:29]5[CH2:30][CH2:31][N:32]([CH3:35])[CH2:33][CH2:34]5)[n:27][cH:28]4)[n:22]3)[CH2:16][CH2:17]2)[nH:4][c:5]([CH3:8])[c:6]1[Cl:7]Participants
5
Sources & evidence
- ORD record
- ord-c2ffbde14a8f447fa00a355077cb0337
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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