Dimethyl Sulfoxide → HCID 50923704, compound

HRID 200385Notes

Reaction equation

HRID 200385 reaction equation
[CH3:39][S:40]([CH3:41])=[O:42].[CH3:43][CH:44]([OH:45])[CH3:46].[NH:30]1[CH2:31][CH:32]([CH2:36][CH2:37][OH:38])[CH2:33][CH2:34][CH2:35]1.[O:1]1[CH:2]([c:4]2[cH:5][cH:6][c:7](-[c:10]3[n:11][o:12][c:13](-[c:15]4[c:16]([C:26]([F:27])([F:28])[F:29])[c:17](-[c:20]5[cH:21][cH:22][cH:23][cH:24][cH:25]5)[n:18][o:19]4)[n:14]3)[cH:8][cH:9]2)[CH2:3]1>>[OH:1][CH:2]([CH2:3][N:30]1[CH2:31][CH:32]([CH2:36][CH2:37][OH:38])[CH2:33][CH2:34][CH2:35]1)[c:4]1[cH:5][cH:6][c:7](-[c:10]2[n:11][o:12][c:13](-[c:15]3[c:16]([C:26]([F:27])([F:28])[F:29])[c:17](-[c:20]4[cH:21][cH:22][cH:23][cH:24][cH:25]4)[n:18][o:19]3)[n:14]2)[cH:8][cH:9]1

Participants

5

Reactant 4

HCID 679Dimethyl SulfoxideHCID 3776IsopropanolHCID 27627163-PiperidineethanolHCID 866563983-(4-(Oxiran-2-yl)phenyl)-5-(3-phenyl-4-(trifluoromethyl)isoxazol-5-yl)-1,2,4-oxadiazole

Product 1

HCID 50923704HCID 50923704, compound

Sources & evidence

ORD record
ord-06f98bc857fb41e2977f49ae685d7539
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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