Dimethyl Sulfoxide → 4-[5-[4-(2-Methylpropyl)phenyl]-1,2,4-oxadiazol-3-YL]benzaldehyde

HRID 1218019Notes

Reaction equation

HRID 1218019 reaction equation
[CH2:11]([CH:12]([CH3:13])[CH3:14])[c:15]1[cH:16][cH:17][c:18](-[c:21]2[n:22][c:23](-[c:26]3[cH:27][cH:28][c:29]([CH2:32][OH:33])[cH:30][cH:31]3)[n:24][o:25]2)[cH:19][cH:20]1.[CH2:43]([Cl:44])[Cl:45].[CH3:1][S:2](=[O:3])[CH3:4].[CH:34]([N:35]([CH2:36][CH3:37])[CH:38]([CH3:39])[CH3:40])([CH3:41])[CH3:42].[Cl:5][C:6]([C:7]([Cl:8])=[O:9])=[O:10]>>[CH2:11]([CH:12]([CH3:13])[CH3:14])[c:15]1[cH:16][cH:17][c:18](-[c:21]2[n:22][c:23](-[c:26]3[cH:27][cH:28][c:29]([CH:32]=[O:33])[cH:30][cH:31]3)[n:24][o:25]2)[cH:19][cH:20]1

Participants

6

Reactant 5

HCID 679Dimethyl SulfoxideHCID 6344DichloromethaneHCID 65578Oxalyl chlorideHCID 81531DiisopropylethylamineHCID 11645224[4-[5-[4-(2-Methylpropyl)phenyl]-1,2,4-oxadiazol-3-yl]phenyl]methanol

Product 1

HCID 184469664-[5-[4-(2-Methylpropyl)phenyl]-1,2,4-oxadiazol-3-YL]benzaldehyde

Sources & evidence

ORD record
ord-d40cbdd61e0147939fc8a06bd8915f16
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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