Hydrochloric Acid → HCID 22387864, compound

HRID 1153440Notes

Reaction equation

HRID 1153440 reaction equation
[CH3:47][N:48]([CH3:49])[CH:50]=[O:51].[ClH:46].[H-:8].[Na+:9].[OH2:52].[OH:1][c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1.[c:10]1([S:16](=[O:17])(=[O:18])[NH:19][C:20](=[O:21])[c:22]2[cH:23][cH:24][c:25]3[c:26]([n:27]2)[n:28]([CH2:32][c:33]2[c:34]([Cl:45])[cH:35][c:36]([CH2:39][O:40][S:41]([CH3:42])(=[O:43])=[O:44])[cH:37][cH:38]2)[c:29]([CH3:31])[n:30]3)[cH:11][cH:12][cH:13][cH:14][cH:15]1>>[O:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[CH2:39][c:36]1[cH:35][c:34]([Cl:45])[c:33]([CH2:32][n:28]2[c:26]3[c:25]([cH:24][cH:23][c:22]([C:20]([NH:19][S:16]([c:10]4[cH:11][cH:12][cH:13][cH:14][cH:15]4)(=[O:17])=[O:18])=[O:21])[n:27]3)[n:30][c:29]2[CH3:31])[cH:38][cH:37]1

Participants

8

Sources & evidence

ORD record
ord-cec95e56777244128a0550d652a022b1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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