Acetate → 5-Amino-1-(4-chlorophenyl)-4-(4-sulfophenylazo)pyrazole
Reaction equation
[CH3:13][C:14](=[O:15])[O-:16].[CH3:30][CH2:31][N:32]([CH2:33][CH3:34])[CH2:35][CH3:36].[ClH:37].[NH2:17][c:18]1[cH:19][cH:20][n:21][n:22]1-[c:23]1[cH:24][cH:25][c:26]([Cl:29])[cH:27][cH:28]1.[Na+:12].[OH2:38].[S:1](=[O:2])([c:3]1[cH:4][cH:5][c:6]([NH2:9])[cH:7][cH:8]1)(=[O:10])[OH:11]>>[S:1](=[O:2])([c:3]1[cH:4][cH:5][c:6]([N:9]=[N:32][c:19]2[c:18]([NH2:17])[n:22](-[c:23]3[cH:24][cH:25][c:26]([Cl:29])[cH:27][cH:28]3)[n:21][cH:20]2)[cH:7][cH:8]1)(=[O:10])[OH:11]Participants
8
Sources & evidence
- ORD record
- ord-e3652b48b24f46ab9195508ebb06f49c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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