Morpholine → (+)-N-(7-[1,4]dioxan-2-yl-4-methoxy-benzothiazol-2-yl)-2-morpholin-4-yl-isonicotinamide

HRID 672746Notes

Reaction equation

HRID 672746 reaction equation
[Br:1][c:2]1[cH:3][c:4]([C:5](=[O:6])[NH:7][c:8]2[s:9][c:10]3[c:11]([n:12]2)[c:13]([O:23][CH3:24])[cH:14][cH:15][c:16]3[CH:17]2[O:18][CH2:19][CH2:20][O:21][CH2:22]2)[cH:25][cH:26][n:27]1.[C:28](=[O:29])([O-:30])[O-:31].[C:34]([c:35]1[c:36]([OH:37])[c:38]([C:39]([CH3:40])([CH3:41])[CH3:42])[cH:43][c:44]([CH3:45])[cH:46]1)([CH3:47])([CH3:48])[CH3:49].[CH2:50]1[CH2:51][O:52][CH2:53][CH2:54][NH:55]1.[Cs+:32].[Cs+:33]>>[c:2]1([N:55]2[CH2:50][CH2:51][O:52][CH2:53][CH2:54]2)[cH:3][c:4]([C:5](=[O:6])[NH:7][c:8]2[s:9][c:10]3[c:11]([n:12]2)[c:13]([O:23][CH3:24])[cH:14][cH:15][c:16]3[CH:17]2[O:18][CH2:19][CH2:20][O:21][CH2:22]2)[cH:25][cH:26][n:27]1

Participants

6

Reactant 5

HCID 8083MorpholineHCID 19660Carbonate IonHCID 314042,6-Di-tert-butyl-4-methylphenolHCID 104967Cesium cation2×HCID 22507693(+)-2-bromo-N-(7-[1,4]dioxan-2-yl-4-methoxy-benzothiazol-2-yl)-isonicotinamide

Product 1

HCID 11419702(+)-N-(7-[1,4]dioxan-2-yl-4-methoxy-benzothiazol-2-yl)-2-morpholin-4-yl-isonicotinamide

Sources & evidence

ORD record
ord-397ba35a486445dda11ae7084dd3a016
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

Loading…