Hydrochloric Acid → HCID 178504784, compound

HRID 1128860Notes

Reaction equation

HRID 1128860 reaction equation
[CH3:39][CH2:40][OH:41].[ClH:30].[F:1][c:2]1[c:3]([N:12]2[CH2:13][CH2:14][c:15]3[c:16]2[n:17][cH:18][n:19][c:20]3[O:21][CH:22]2[CH2:23][CH2:24][N:25]([C:28]#[N:29])[CH2:26][CH2:27]2)[cH:4][cH:5][c:6]([S:8](=[O:9])(=[O:10])[CH3:11])[cH:7]1.[NH2:31][OH:32].[Na+:33].[Na+:34].[O-:35][C:36](=[O:37])[O-:38]>>[F:1][c:2]1[c:3]([N:12]2[CH2:13][CH2:14][c:15]3[c:16]2[n:17][cH:18][n:19][c:20]3[O:21][CH:22]2[CH2:23][CH2:24][N:25]([C:28](=[NH:29])[NH:31][OH:32])[CH2:26][CH2:27]2)[cH:4][cH:5][c:6]([S:8](=[O:9])(=[O:10])[CH3:11])[cH:7]1

Participants

7

Reactant 6

HCID 313Hydrochloric AcidHCID 702EthanolHCID 787HydroxylamineHCID 923Sodium ion2×HCID 19660Carbonate IonHCID 866374114-[[7-(2-Fluoro-4-methylsulfonylphenyl)-5,6-dihydropyrrolo[2,3-d]pyrimidin-4-yl]oxy]piperidine-1-carbonitrile

Product 1

HCID 178504784HCID 178504784, compound

Sources & evidence

ORD record
ord-9a9686efa72f44c08e1170617d2b3cc9
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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