Dimethyl Sulfoxide → HCID 50907431, compound

HRID 696228Notes

Reaction equation

HRID 696228 reaction equation
[CH3:23][S:24]([CH3:25])=[O:26].[CH3:35][CH2:36][O:37][C:38](=[O:39])[CH3:40].[Cl:1][c:2]1[c:3](-[c:9]2[cH:10][n:11][cH:12][c:13]([NH:15][CH2:16][CH:17]3[CH2:18][CH2:19][O:20][CH2:21][CH2:22]3)[n:14]2)[cH:4][c:5]([F:8])[n:6][cH:7]1.[NH2:27][CH:28]1[CH2:29][CH2:30][CH:31]([OH:34])[CH2:32][CH2:33]1>>[Cl:1][c:2]1[c:3](-[c:9]2[cH:10][n:11][cH:12][c:13]([NH:15][CH2:16][CH:17]3[CH2:18][CH2:19][O:20][CH2:21][CH2:22]3)[n:14]2)[cH:4][c:5]([NH:27][CH:28]2[CH2:29][CH2:30][CH:31]([OH:34])[CH2:32][CH2:33]2)[n:6][cH:7]1

Participants

5

Reactant 4

HCID 679Dimethyl SulfoxideHCID 8857Ethyl AcetateHCID 812934-AminocyclohexanolHCID 66937030HCID 66937030, compound

Product 1

HCID 50907431HCID 50907431, compound

Sources & evidence

ORD record
ord-36a5be0ea1b648458fa8fcf03cff0472
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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