Trifluoroacetic acid → 2-(4-(2-(1-isopropyl-1H-1,2,4-triazol-5-yl)-5,6-dihydrobenzo[f]imidazo[1,2-d][1,4]oxazepin-9-yl)piperidin-1-yl)-N,N-dimethylethanesulfonamide

HRID 947598Notes

Reaction equation

HRID 947598 reaction equation
[CH3:36][N:37]([S:38](=[O:39])(=[O:40])[CH:41]=[CH2:42])[CH3:43].[CH:8]([CH3:9])([CH3:10])[n:11]1[n:12][cH:13][n:14][c:15]1-[c:16]1[cH:17][n:18]2[c:24]([n:25]1)-[c:23]1[c:22]([cH:29][c:28]([CH:30]3[CH2:31][CH2:32][NH:33][CH2:34][CH2:35]3)[cH:27][cH:26]1)[O:21][CH2:20][CH2:19]2.[F:1][C:2]([F:3])([F:4])[C:5]([OH:6])=[O:7]>>[CH:8]([CH3:9])([CH3:10])[n:11]1[n:12][cH:13][n:14][c:15]1-[c:16]1[cH:17][n:18]2[c:24]([n:25]1)-[c:23]1[c:22]([cH:29][c:28]([CH:30]3[CH2:31][CH2:32][N:33]([CH2:42][CH2:41][S:38]([N:37]([CH3:36])[CH3:43])(=[O:39])=[O:40])[CH2:34][CH2:35]3)[cH:27][cH:26]1)[O:21][CH2:20][CH2:19]2

Participants

4

Reactant 3

HCID 6422Trifluoroacetic acidHCID 19037148N,N-dimethylethene-1-sulfonamideHCID 582045509-Piperidin-4-yl-2-(2-propan-2-yl-1,2,4-triazol-3-yl)-5,6-dihydroimidazo[1,2-d][1,4]benzoxazepine

Product 1

HCID 582048542-(4-(2-(1-isopropyl-1H-1,2,4-triazol-5-yl)-5,6-dihydrobenzo[f]imidazo[1,2-d][1,4]oxazepin-9-yl)piperidin-1-yl)-N,N-dimethylethanesulfonamide

Sources & evidence

ORD record
ord-8ab1bcfbef3a4165a1c78fab37b35a73
Source dataset
Validation data from https://doi.org/10.1039/C8SC04228D

Reaction notes

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