Hydrochloric Acid → [5-(1-Isopropyl-piperidin-4-yloxy)-1H-indol-2-yl]-[4-(2,2,2-trifluoro-ethanesulfonyl)-piperazin-1-yl]-methanone

HRID 684625Notes

Reaction equation

HRID 684625 reaction equation
[CH:3]([CH3:4])([CH3:5])[N:6]1[CH2:7][CH2:8][CH:9]([O:12][c:13]2[cH:14][c:15]3[cH:16][c:17]([C:22](=[O:23])[N:24]4[CH2:25][CH2:26][NH:27][CH2:28][CH2:29]4)[nH:18][c:19]3[cH:20][cH:21]2)[CH2:10][CH2:11]1.[ClH:1].[ClH:2].[F:30][C:31]([CH2:32][S:33](=[O:34])(=[O:35])[Cl:36])([F:37])[F:38]>>[CH:3]([CH3:4])([CH3:5])[N:6]1[CH2:7][CH2:8][CH:9]([O:12][c:13]2[cH:14][c:15]3[cH:16][c:17]([C:22](=[O:23])[N:24]4[CH2:25][CH2:26][N:27]([S:33]([CH2:32][C:31]([F:30])([F:37])[F:38])(=[O:34])=[O:35])[CH2:28][CH2:29]4)[nH:18][c:19]3[cH:20][cH:21]2)[CH2:10][CH2:11]1

Participants

4

Reactant 3

HCID 313Hydrochloric Acid2×HCID 742422,2,2-Trifluoroethanesulfonyl chlorideHCID 68565071piperazin-1-yl-[5-(1-propan-2-ylpiperidin-4-yl)oxy-1H-indol-2-yl]methanone

Product 1

HCID 68565366[5-(1-Isopropyl-piperidin-4-yloxy)-1H-indol-2-yl]-[4-(2,2,2-trifluoro-ethanesulfonyl)-piperazin-1-yl]-methanone

Sources & evidence

ORD record
ord-dd2457a982de434e94819343fc178f97
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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