Dichloromethane → (4-{[Benzyl({[3,5-bis(trifluoromethyl)benzoyl]amino}sulfonyl)amino]methyl}cyclohexyl)methyl methanesulfonate

HRID 1564089Notes

Reaction equation

HRID 1564089 reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]([S:9](=[O:10])(=[O:11])[NH:12][C:13]([c:14]1[cH:15][c:16]([C:24]([F:25])([F:26])[F:27])[cH:17][c:18]([C:20]([F:21])([F:22])[F:23])[cH:19]1)=[O:28])[CH2:29][CH:30]1[CH2:31][CH2:32][CH:33]([CH2:36][OH:37])[CH2:34][CH2:35]1.[CH3:38][CH2:39][N:40]([CH2:41][CH3:42])[CH2:43][CH3:44].[CH3:45][S:46]([Cl:47])(=[O:48])=[O:49].[Cl:50][CH2:51][Cl:52]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]([S:9](=[O:10])(=[O:11])[NH:12][C:13]([c:14]1[cH:15][c:16]([C:24]([F:25])([F:26])[F:27])[cH:17][c:18]([C:20]([F:21])([F:22])[F:23])[cH:19]1)=[O:28])[CH2:29][CH:30]1[CH2:31][CH2:32][CH:33]([CH2:36][O:37][S:46]([CH3:45])(=[O:48])=[O:49])[CH2:34][CH2:35]1

Participants

5

Reactant 4

HCID 6344DichloromethaneHCID 8471TriethylamineHCID 31297Methanesulfonyl chlorideHCID 22574483N-benzyl-N'-[3,5-bis(trifluoromethyl)benzoyl]-N-{[4-(hydroxymethyl)cyclohexyl]methyl}sulfamide

Product 1

HCID 22574476(4-{[Benzyl({[3,5-bis(trifluoromethyl)benzoyl]amino}sulfonyl)amino]methyl}cyclohexyl)methyl methanesulfonate

Sources & evidence

ORD record
ord-61c1a12b07854c4c9ac239a226d07f1e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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