Hydrochloric Acid → HCID 86637399, compound
Reaction equation
[CH2:37]([Cl:38])[Cl:39].[CH3:8][S:9](=[O:10])(=[O:11])[c:12]1[cH:13][cH:14][c:15]([N:18]2[CH2:19][CH2:20][c:21]3[c:22]([O:27][CH:28]4[CH2:29][CH2:30][NH:31][CH2:32][CH2:33]4)[cH:23][cH:24][cH:25][c:26]32)[cH:16][cH:17]1.[ClH:7].[N:34]#[C:35][Br:36].[Na+:5].[O-:1][C:2]([OH:3])=[O:4].[OH2:6]>>[CH3:8][S:9](=[O:10])(=[O:11])[c:12]1[cH:13][cH:14][c:15]([N:18]2[CH2:19][CH2:20][c:21]3[c:22]([O:27][CH:28]4[CH2:29][CH2:30][N:31]([C:35]#[N:34])[CH2:32][CH2:33]4)[cH:23][cH:24][cH:25][c:26]32)[cH:16][cH:17]1Participants
8
Sources & evidence
- ORD record
- ord-90b294d2703d49efb94371b3a428c89f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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