Water → HCID 178477927, compound
Reaction equation
[CH3:43][CH2:44][O:45][C:46](=[O:47])[CH3:48].[CH:11]1([N:20]=[C:21]=[S:22])[CH2:12][CH2:13][c:14]2[cH:15][cH:16][cH:17][cH:18][c:19]21.[CH:23]1([N:24]=[C:25]=[N:26][CH:27]2[CH2:28][CH2:29][CH2:30][CH2:31][CH2:32]2)[CH2:33][CH2:34][CH2:35][CH2:36][CH2:37]1.[NH2:1][c:2]1[c:3]([CH2:4][OH:5])[c:6]([Cl:10])[cH:7][cH:8][cH:9]1.[O:38]1[CH2:39][CH2:40][CH2:41][CH2:42]1.[OH2:49]>>[N:1]1=[C:21]([NH:20][CH:11]2[CH2:12][CH2:13][c:14]3[cH:15][cH:16][cH:17][cH:18][c:19]32)[O:5][CH2:4][c:3]2[c:2]1[cH:9][cH:8][cH:7][c:6]2[Cl:10]Participants
7
Sources & evidence
- ORD record
- ord-19b0fe1a48af458c87b746b7b13638b3
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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