Hydrochloric Acid → HCID 23060858, compound

HRID 194017Notes

Reaction equation

HRID 194017 reaction equation
[C:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)(=[O:8])[c:9]1[c:10]([C:11](=[O:12])[N:13]([CH2:14][c:15]2[cH:16][cH:17][c:18]([S:21](=[O:22])(=[O:23])[CH3:24])[cH:19][cH:20]2)[CH2:25][CH:26]([CH2:27][c:28]2[cH:29][cH:30][cH:31][cH:32][cH:33]2)[OH:34])[cH:35][cH:36][c:37]([Br:39])[cH:38]1.[CH3:40][CH2:41][N:42]([CH2:43][CH3:44])[CH2:45][CH3:46].[CH3:58][S:59]([CH3:60])=[O:61].[ClH:57].[OH2:62].[S:47](=[O:48])(=[O:49])=[O:50].[n:51]1[cH:52][cH:53][cH:54][cH:55][cH:56]1>>[C:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)(=[O:8])[c:9]1[c:10]([C:11](=[O:12])[N:13]([CH2:14][c:15]2[cH:16][cH:17][c:18]([S:21](=[O:22])(=[O:23])[CH3:24])[cH:19][cH:20]2)[CH2:25][C:26]([CH2:27][c:28]2[cH:29][cH:30][cH:31][cH:32][cH:33]2)=[O:34])[cH:35][cH:36][c:37]([Br:39])[cH:38]1

Participants

8

Reactant 7

HCID 313Hydrochloric AcidHCID 679Dimethyl SulfoxideHCID 962WaterHCID 1049PyridineHCID 8471TriethylamineHCID 24682Sulfur trioxideHCID 23060894HCID 23060894, compound

Product 1

HCID 23060858HCID 23060858, compound

Sources & evidence

ORD record
ord-a4b8a9f5f1204ca787545ff79b2ecc90
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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