Hydrochloric Acid → Des-6-[4-(2-hydroxyethyl)-1-piperazinyl]-6-chloro-O-pivalate Dasatinib
Reaction equation
[C:1]([C:2]([CH3:3])([CH3:4])[CH3:5])(=[O:6])[O:7][CH2:8][c:9]1[c:10]([NH:16][C:17](=[O:18])[c:19]2[cH:20][n:21][c:22]([NH2:24])[s:23]2)[c:11]([Cl:15])[cH:12][cH:13][cH:14]1.[CH2:35]1[O:36][CH2:37][CH2:38][CH2:39]1.[Cl:25][c:26]1[n:27][c:28]([CH3:33])[n:29][c:30]([Cl:32])[cH:31]1.[ClH:34]>>[C:1]([C:2]([CH3:3])([CH3:4])[CH3:5])(=[O:6])[O:7][CH2:8][c:9]1[c:10]([NH:16][C:17](=[O:18])[c:19]2[cH:20][n:21][c:22]([NH:24][c:30]3[n:29][c:28]([CH3:33])[n:27][c:26]([Cl:25])[cH:31]3)[s:23]2)[c:11]([Cl:15])[cH:12][cH:13][cH:14]1Participants
5
Sources & evidence
- ORD record
- ord-b6d627c9f91748a78637f50c8242dbba
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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