Water → HCID 178504841, compound

HRID 93856Notes

Reaction equation

HRID 93856 reaction equation
[Br:1][c:2]1[c:3]2[cH:4][cH:5][cH:6][n:7][c:8]2[c:9]([OH:25])[c:10](-[c:12]2[n:13][n:14][c:15]([CH2:17][c:18]3[cH:19][cH:20][c:21]([F:24])[cH:22][cH:23]3)[nH:16]2)[n:11]1.[CH3:26][S:27](=[O:28])[OH:29].[CH3:32][N:33]1[C:34](=[O:35])[CH2:36][CH2:37][CH2:38]1.[Na:30].[OH2:31]>>[c:2]1([S:27]([CH3:26])(=[O:28])=[O:29])[c:3]2[cH:4][cH:5][cH:6][n:7][c:8]2[c:9]([OH:25])[c:10](-[c:12]2[n:13][n:14][c:15]([CH2:17][c:18]3[cH:19][cH:20][c:21]([F:24])[cH:22][cH:23]3)[nH:16]2)[n:11]1

Participants

6

Reactant 5

HCID 962WaterHCID 13387N-methyl-2-pyrrolidoneHCID 87251Methanesulfinic acidHCID 5360545SodiumHCID 178515407HCID 178515407, compound

Product 1

HCID 178504841HCID 178504841, compound

Sources & evidence

ORD record
ord-e94adcd99bbb4afe960e8d97b3eb605a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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