Water → HCID 57964881, compound

HRID 1133829Notes

Reaction equation

HRID 1133829 reaction equation
[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.[Cl:34][c:35]1[cH:36][c:37]([C:38](=[O:39])[Cl:40])[cH:41][c:42]([Cl:44])[cH:43]1.[F:1][C:2]([F:3])([F:4])[C:5]([OH:6])=[O:7].[OH2:45]>>[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:38]([c:37]4[cH:36][c:35]([Cl:34])[cH:43][c:42]([Cl:44])[cH:41]4)=[O:39])[CH2:30][CH2:31]2)[n:24][cH:25]3)[cH:32][cH:33]1

Participants

5

Reactant 4

HCID 962WaterHCID 6422Trifluoroacetic acidHCID 761913,5-Dichlorobenzoyl chlorideHCID 579649614-(4-Methylsulfonylphenoxy)-1-piperidin-4-ylpyrazolo[5,4-d]pyrimidine

Product 1

HCID 57964881HCID 57964881, compound

Sources & evidence

ORD record
ord-51c0de1daedf4a45b22d6a756a247429
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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