Water → HCID 86733211, compound
Reaction equation
[OH2:27].[c:1]1([SH:7]=[C:8]([Cl:9])[Cl:10])[cH:2][cH:3][cH:4][cH:5][cH:6]1.[cH:11]1[cH:12][cH:13][cH:14][c:15]2[c:24]1[CH:23]([NH:25][OH:26])[c:22]1[c:17]([cH:18][cH:19][cH:20][cH:21]1)[O:16]2.[cH:28]1[cH:29][cH:30][n:31][cH:32][cH:33]1>>[c:1]1([S:7][C:8]([N:25]([CH:23]2[c:22]3[c:17]([cH:18][cH:19][cH:20][cH:21]3)[O:16][c:15]3[cH:14][cH:13][cH:12][cH:11][c:24]32)[OH:26])=[O:27])[cH:2][cH:3][cH:4][cH:5][cH:6]1Participants
5
Sources & evidence
- ORD record
- ord-3f1c6a5d4f4046a4be25b98d03646248
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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