Carbonate Ion → 4-chloro-N-[2-(hydroxymethyl)cyclohexyl]-N-[[4-(1,2,4-oxadiazol-3-yl)phenyl]methyl]benzenesulfonamide

HRID 2122782Notes

Reaction equation

HRID 2122782 reaction equation
[Br:26][CH2:27][c:28]1[cH:29][cH:30][c:31](-[c:34]2[n:35][o:36][cH:37][n:38]2)[cH:32][cH:33]1.[C:20](=[O:21])([O-:22])[O-:23].[Cl:1][c:2]1[cH:3][cH:4][c:5]([S:8](=[O:9])(=[O:10])[NH:11][CH:12]2[CH:13]([CH2:18][OH:19])[CH2:14][CH2:15][CH2:16][CH2:17]2)[cH:6][cH:7]1.[Cl:39][c:40]1[cH:41][cH:42][c:43]([S:44]([N:45]([CH2:46][c:47]2[cH:48][cH:49][c:50](-[c:51]3[o:52][cH:53][cH:54][n:55]3)[c:56]([F:57])[c:58]2[F:59])[CH:60]2[CH2:61][CH2:62][CH2:63][CH2:64][CH:65]2[CH2:66][OH:67])(=[O:68])=[O:69])[cH:70][cH:71]1.[Cs+:24].[Cs+:25]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([S:8](=[O:9])(=[O:10])[N:11]([CH:12]2[CH:13]([CH2:18][OH:19])[CH2:14][CH2:15][CH2:16][CH2:17]2)[CH2:27][c:28]2[cH:29][cH:30][c:31](-[c:34]3[n:35][o:36][cH:37][n:38]3)[cH:32][cH:33]2)[cH:6][cH:7]1

Participants

6

Reactant 5

HCID 19660Carbonate IonHCID 104967Cesium cation2×HCID 469271114-chloro-N-[[2,3-difluoro-4-(1,3-oxazol-2-yl)phenyl]methyl]-N-[2-(hydroxymethyl)cyclohexyl]benzenesulfonamideHCID 666700193-(4-(Bromomethyl)phenyl)-1,2,4-oxadiazoleHCID 673146974-chloro-N-[2-(hydroxymethyl)cyclohexyl]benzenesulfonamide

Product 1

HCID 469271124-chloro-N-[2-(hydroxymethyl)cyclohexyl]-N-[[4-(1,2,4-oxadiazol-3-yl)phenyl]methyl]benzenesulfonamide

Sources & evidence

ORD record
ord-943f4b98ebba46fb90e62c6ced4257ff
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

Loading…