2,2,2-Trifluoroethanol → HCID 57989859, compound

HRID 697198Notes

Reaction equation

HRID 697198 reaction equation
[CH3:36][S:37](=[O:38])(=[O:39])[N:40]1[CH2:41][CH2:42][CH:43]([NH2:46])[CH2:44][CH2:45]1.[Cl:1][c:2]1[n:3][cH:4][cH:5][c:6](-[c:8]2[c:9](-[c:17]3[c:18]([F:35])[c:19]([NH:23][S:24](=[O:25])(=[O:26])[c:27]4[c:28]([F:34])[cH:29][cH:30][cH:31][c:32]4[F:33])[cH:20][cH:21][cH:22]3)[n:10][c:11]([C:13]([CH3:14])([CH3:15])[CH3:16])[s:12]2)[n:7]1.[OH:47][CH2:48][C:49]([F:50])([F:51])[F:52]>>[c:2]1([NH:46][CH:43]2[CH2:42][CH2:41][N:40]([S:37]([CH3:36])(=[O:38])=[O:39])[CH2:45][CH2:44]2)[n:3][cH:4][cH:5][c:6](-[c:8]2[c:9](-[c:17]3[c:18]([F:35])[c:19]([NH:23][S:24](=[O:25])(=[O:26])[c:27]4[c:28]([F:34])[cH:29][cH:30][cH:31][c:32]4[F:33])[cH:20][cH:21][cH:22]3)[n:10][c:11]([C:13]([CH3:14])([CH3:15])[CH3:16])[s:12]2)[n:7]1

Participants

4

Reactant 3

HCID 64092,2,2-TrifluoroethanolHCID 113558261-(Methanesulfonyl)piperidin-4-amineHCID 57989782N-(3-(5-(2-chloro-4-pyrimidinyl)-2-(1,1-diethylethyl)-1,3-thiazol-4-yl)-2-fluoraphenyl)-2,6-difluorobenzenesulfonamide

Product 1

HCID 57989859HCID 57989859, compound

Sources & evidence

ORD record
ord-743e43c3727c4a10b68e9c5fb84bb415
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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