Hydrochloric Acid → Hydrochloric Acid

HRID 669959Notes

Reaction equation

HRID 669959 reaction equation
[C:1]([O:2][C:3](=[O:4])[N:8]1[CH2:9][CH2:10][N:11]([c:14]2[c:15]([O:35][CH3:36])[cH:16][cH:17][c:18]([N:20]([CH3:21])[S:22](=[O:23])(=[O:24])[c:25]3[cH:26][c:27]([O:31][CH:32]([F:33])[F:34])[cH:28][cH:29][cH:30]3)[cH:19]2)[CH2:12][CH2:13]1)([CH3:5])([CH3:6])[CH3:7].[CH3:38][CH2:39][OH:40].[CH:41]([OH:42])([CH3:43])[CH3:44].[ClH:37]>>[ClH:37].[NH:8]1[CH2:9][CH2:10][N:11]([c:14]2[c:15]([O:35][CH3:36])[cH:16][cH:17][c:18]([N:20]([CH3:21])[S:22](=[O:23])(=[O:24])[c:25]3[cH:26][c:27]([O:31][CH:32]([F:33])[F:34])[cH:28][cH:29][cH:30]3)[cH:19]2)[CH2:12][CH2:13]1

Participants

6

Reactant 4

HCID 313Hydrochloric AcidHCID 702EthanolHCID 3776IsopropanolHCID 576995094-{5-[(3-difluoromethoxy-benzenesulfonyl)-methyl-amino]-2-methoxy-phenyl}-piperazine-1-carboxylic Acid tert-butyl Ester

Product 2

HCID 313Hydrochloric AcidHCID 426029073-(difluoromethoxy)-N-(4-methoxy-3-piperazin-1-ylphenyl)-N-methylbenzenesulfonamide

Sources & evidence

ORD record
ord-85aefec2ffbc4e0db2fad3c59b977843
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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