Hydrochloric Acid → HCID 178467329, compound

HRID 319304Notes

Reaction equation

HRID 319304 reaction equation
[C:54]([Cl:55])([Cl:56])([Cl:57])[Cl:58].[CH2:1]([S:2][CH:4]1[CH:5]([CH:46]([CH3:47])[OH:48])[C:6](=[O:45])[N:7]1[C:8]([C:9](=[S:10])[O:11][CH2:12][c:13]1[cH:14][cH:15][c:16]([N+:19](=[O:20])[O-:21])[cH:17][cH:18]1)=[C:22]([C:23]([C:24]([CH3:25])([CH3:26])[CH3:27])=[O:28])[O:29][c:30]1[cH:31][cH:32][c:33]([C:36](=[O:37])[S:38][c:39]2[cH:40][cH:41][cH:42][cH:43][cH:44]2)[cH:34][cH:35]1)[CH3:3].[CH:50]([Cl:51])([Cl:52])[Cl:53].[Cl:49]>>[CH:4]1([Cl:51])[CH:5]([CH:46]([CH3:47])[OH:48])[C:6](=[O:45])[N:7]1[C:8]([C:9](=[S:10])[O:11][CH2:12][c:13]1[cH:14][cH:15][c:16]([N+:19](=[O:20])[O-:21])[cH:17][cH:18]1)=[C:22]([C:23]([C:24]([CH3:25])([CH3:26])[CH3:27])=[O:28])[O:29][c:30]1[cH:31][cH:32][c:33]([C:36](=[O:37])[S:38][c:39]2[cH:40][cH:41][cH:42][cH:43][cH:44]2)[cH:34][cH:35]1

Participants

5

Sources & evidence

ORD record
ord-0c48f265b37e4141a2e37fc1d8693ec3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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