1-(4-chlorophenyl)-5-methyl-1H-pyrazole-4-carboxylic acid → HCID 22227919, compound
Reaction equation
[Cl:1][c:2]1[cH:3][cH:4][c:5](-[n:8]2[n:9][cH:10][c:11]([C:14](=[O:15])[OH:16])[c:12]2[CH3:13])[cH:6][cH:7]1.[NH2:17][c:18]1[cH:19][cH:20][c:21]([N:26]2[CH2:27][CH2:28][CH:29]([N:32]([CH2:33][CH2:34][OH:35])[CH2:36][CH2:37][OH:38])[CH2:30][CH2:31]2)[c:22]([C:23]#[N:24])[cH:25]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5](-[n:8]2[n:9][cH:10][c:11]([C:14](=[O:16])[NH:17][c:18]3[cH:19][cH:20][c:21]([N:26]4[CH2:27][CH2:28][CH:29]([N:32]([CH2:33][CH2:34][OH:35])[CH2:36][CH2:37][OH:38])[CH2:30][CH2:31]4)[c:22]([C:23]#[N:24])[cH:25]3)[c:12]2[CH3:13])[cH:6][cH:7]1Participants
3
Sources & evidence
- ORD record
- ord-716316384495420d8a07ad92364728f0
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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