Hydrochloric Acid → 2-{[3-tert-butyl-1-(2-methylphenyl)-1H-pyrazol-5-yl]amino}-5-ethylbenzoic acid
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[n:6][n:7](-[c:23]2[c:24]([CH3:29])[cH:25][cH:26][cH:27][cH:28]2)[c:8]([NH:10][c:11]2[c:12]([C:13](=[O:14])[O:15][CH3:16])[cH:17][c:18]([CH2:21][CH3:22])[cH:19][cH:20]2)[cH:9]1.[CH2:36]1[O:37][CH2:38][CH2:39][CH2:40]1.[CH3:34][OH:35].[ClH:33].[Li+:32].[OH-:31].[OH2:30].[OH2:41]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[n:6][n:7](-[c:23]2[c:24]([CH3:29])[cH:25][cH:26][cH:27][cH:28]2)[c:8]([NH:10][c:11]2[c:12]([C:13](=[O:14])[OH:15])[cH:17][c:18]([CH2:21][CH3:22])[cH:19][cH:20]2)[cH:9]1Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-2a7ac439b8b2461fa91c5aa667d1963e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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