Water → HCID 56956241, compound
Reaction equation
[CH3:28][S:29]([Cl:30])(=[O:31])=[O:32].[Cl:33][CH2:34][Cl:35].[NH2:1][c:2]1[c:3]([CH:8]2[NH:9][c:10]3[cH:11][cH:12][c:13]([C:20]#[N:21])[cH:14][c:15]3[C:16]([CH3:18])([CH3:19])[CH2:17]2)[cH:4][cH:5][cH:6][cH:7]1.[OH2:36].[cH:22]1[cH:23][cH:24][n:25][cH:26][cH:27]1>>[NH:1]([c:2]1[c:3]([CH:8]2[NH:9][c:10]3[cH:11][cH:12][c:13]([C:20]#[N:21])[cH:14][c:15]3[C:16]([CH3:18])([CH3:19])[CH2:17]2)[cH:4][cH:5][cH:6][cH:7]1)[S:29]([CH3:28])(=[O:31])=[O:32]Participants
6
Sources & evidence
- ORD record
- ord-76759b274d9c4179ae89db23814f15df
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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