Dimethyl Sulfoxide → HCID 178488382, compound

HRID 205749Notes

Reaction equation

HRID 205749 reaction equation
[CH3:1][c:2]1[cH:3][cH:4][c:5]([S:6]([O:7][CH2:12][CH:13]2[CH2:14][O:15][c:16]3[c:17]([c:19]([O:23][CH3:24])[cH:20][cH:21][cH:22]3)[O:18]2)(=[O:8])=[O:9])[cH:10][cH:11]1.[CH3:43][S:44]([CH3:45])=[O:46].[F:25][c:26]1[cH:27][c:28]2[c:29]([CH:35]3[CH2:36][CH:37]([NH2:40])[CH2:38][CH2:39]3)[cH:30][nH:31][c:32]2[cH:33][cH:34]1.[Na+:42].[OH-:41]>>[CH2:12]([CH:13]1[CH2:14][O:15][c:16]2[c:17]([c:19]([O:23][CH3:24])[cH:20][cH:21][cH:22]2)[O:18]1)[NH:40][CH:37]1[CH2:36][CH:35]([c:29]2[c:28]3[cH:27][c:26]([F:25])[cH:34][cH:33][c:32]3[nH:31][cH:30]2)[CH2:39][CH2:38]1

Participants

6

Reactant 5

HCID 679Dimethyl SulfoxideHCID 923Sodium ionHCID 961HydroxideHCID 104980328-Methoxy-1,4-benzodioxan-2-ylmethyl toluene-4-sulphonateHCID 221491433-(5-fluoro-1H-indol-3-yl)-cyclopentylamine

Product 1

HCID 178488382HCID 178488382, compound

Sources & evidence

ORD record
ord-b39bab6bbc194072a3fedab14aef9dd9
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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