Hydrochloric Acid → N-[[4-[[4-thiophen-2-ylsulfonyl-1-[4-(1,1,1-trifluoro-2-hydroxypropan-2-yl)phenyl]piperazin-2-yl]methyl]morpholin-3-yl]methyl]methanesulfonamide

HRID 305379Notes

Reaction equation

HRID 305379 reaction equation
[C:47](=[O:48])([O-:49])[O-:50].[CH3:1][S:2]([O:3][CH2:6][CH:7]1[N:8]([c:21]2[cH:22][cH:23][c:24]([C:27]([C:28]([F:29])([F:30])[F:31])([CH3:32])[OH:33])[cH:25][cH:26]2)[CH2:9][CH2:10][N:11]([S:13](=[O:14])(=[O:15])[c:16]2[s:17][cH:18][cH:19][cH:20]2)[CH2:12]1)(=[O:4])=[O:5].[ClH:34].[K+:51].[K+:52].[O:35]1[CH2:36][CH:37]([CH2:41][NH:42][S:43](=[O:44])(=[O:45])[CH3:46])[NH:38][CH2:39][CH2:40]1>>[CH2:6]([CH:7]1[N:8]([c:21]2[cH:22][cH:23][c:24]([C:27]([C:28]([F:29])([F:30])[F:31])([CH3:32])[OH:33])[cH:25][cH:26]2)[CH2:9][CH2:10][N:11]([S:13](=[O:14])(=[O:15])[c:16]2[s:17][cH:18][cH:19][cH:20]2)[CH2:12]1)[N:38]1[CH:37]([CH2:41][NH:42][S:43](=[O:44])(=[O:45])[CH3:46])[CH2:36][O:35][CH2:40][CH2:39]1

Participants

6

Reactant 5

HCID 313Hydrochloric AcidHCID 813Potassium Cation2×HCID 19660Carbonate IonHCID 66582523N-(morpholin-3-ylmethyl)methanesulfonamideHCID 86670324(4-(2-Thiophenylsulfonyl)-1-(4-(2,2,2-trifluoro-1-hydroxy-1-methylethyl)phenyl)-2-piperazinyl)methyl methanesulfonate

Product 1

HCID 76462322N-[[4-[[4-thiophen-2-ylsulfonyl-1-[4-(1,1,1-trifluoro-2-hydroxypropan-2-yl)phenyl]piperazin-2-yl]methyl]morpholin-3-yl]methyl]methanesulfonamide

Sources & evidence

ORD record
ord-7dde5c47cec34a05ab8aa8d106a4d393
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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