Water → HCID 57965016, compound

HRID 1144720Notes

Reaction equation

[C:34]([CH:35]([CH3:36])[CH3:37])(=[O:38])[Cl:39].[CH3:8][S:9](=[O:10])(=[O:11])[c:12]1[cH:13][cH:14][c:15]([O:16][c:17]2[c:18]3[c:19]([n:20][cH:21][n:22]2)[n:23]([CH:26]2[CH2:27][CH2:28][NH:29][CH2:30][CH2:31]2)[n:24][cH:25]3)[cH:32][cH:33]1.[F:1][C:2]([F:3])([F:4])[C:5]([OH:6])=[O:7].[OH2:40]>>[CH3:8][S:9](=[O:10])(=[O:11])[c:12]1[cH:13][cH:14][c:15]([O:16][c:17]2[c:18]3[c:19]([n:20][cH:21][n:22]2)[n:23]([CH:26]2[CH2:27][CH2:28][N:29]([C:34]([CH:35]([CH3:36])[CH3:37])=[O:38])[CH2:30][CH2:31]2)[n:24][cH:25]3)[cH:32][cH:33]1

Participants

Reactant 4

HCID 962Water

HCID 6422Trifluoroacetic acid

HCID 62325Isobutyryl chloride

HCID 579649614-(4-Methylsulfonylphenoxy)-1-piperidin-4-ylpyrazolo[5,4-d]pyrimidine

Product 1

HCID 57965016HCID 57965016, compound

Sources & evidence

ORD record: ord-f40849cb4a2643daa2bd06fbd9d55ef4
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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