Hydrochloric Acid → Hydrochloric Acid

HRID 2157550Notes

Reaction equation

HRID 2157550 reaction equation
[CH3:62][CH2:63][OH:64].[CH3:65][CH:66]([OH:67])[CH3:68].[Cl:1][c:2]1[cH:3][cH:4][c:5]2[c:22]([cH:23]1)[CH2:21][CH2:20][c:19]1[c:6]-2[n:7](-[c:8]2[cH:9][cH:10][cH:11][cH:12][cH:13]2)[n:14][c:15]1[C:16]([OH:17])=[O:18].[Cl:31][c:32]1[cH:33][cH:34][c:35]2[c:36]([cH:60]1)[CH2:37][CH2:38][c:39]1[c:40]([C:50](=[O:51])[O:52][CH2:53][CH2:54][N:55]([CH2:56][CH3:57])[CH2:58][CH3:59])[n:41][n:42](-[c:44]3[cH:45][cH:46][cH:47][cH:48][cH:49]3)[c:43]1-2.[ClH:61].[O:28]=[S:29]=[O:30].[S:24]([Cl:25])([Cl:26])=[O:27]>>[Cl:31][c:32]1[cH:33][cH:34][c:35]2[c:36]([cH:60]1)[CH2:37][CH2:38][c:39]1[c:40]([C:50](=[O:51])[O:52][CH2:53][CH2:54][N:55]([CH2:56][CH3:57])[CH2:58][CH3:59])[n:41][n:42](-[c:44]3[cH:45][cH:46][cH:47][cH:48][cH:49]3)[c:43]1-2.[ClH:1]

Participants

9

Sources & evidence

ORD record
ord-2fe672ef37b847daa8a059e58181d37c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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