Dimethyl Sulfoxide → HCID 178421924, compound

HRID 320712Notes

Reaction equation

HRID 320712 reaction equation
[CH3:28][CH2:29][N:30]([CH2:31][CH3:32])[CH2:33][CH3:34].[CH3:35][N:36]([CH:37]1[CH2:38][NH:39][CH2:40][CH2:41]1)[CH3:42].[CH3:43][CH2:44][O:45][C:46](=[O:47])[CH3:48].[CH3:49][S:50]([CH3:51])=[O:52].[F:1][c:2]1[c:3](-[c:22]2[cH:23][cH:24][cH:25][cH:26][cH:27]2)[c:4]([CH3:21])[c:5]([C:19]#[N:20])[c:6]2[n:7][c:8]([CH:11]=[CH:12][c:13]3[cH:14][cH:15][cH:16][cH:17][cH:18]3)[o:9][c:10]12.[OH2:53]>>[c:2]1([N:39]2[CH2:38][CH:37]([N:36]([CH3:35])[CH3:42])[CH2:41][CH2:40]2)[c:3](-[c:22]2[cH:23][cH:24][cH:25][cH:26][cH:27]2)[c:4]([CH3:21])[c:5]([C:19]#[N:20])[c:6]2[n:7][c:8]([CH:11]=[CH:12][c:13]3[cH:14][cH:15][cH:16][cH:17][cH:18]3)[o:9][c:10]12

Participants

7

Reactant 6

HCID 679Dimethyl SulfoxideHCID 962WaterHCID 8471TriethylamineHCID 8857Ethyl AcetateHCID 27585193-(Dimethylamino)pyrrolidineHCID 68585477HCID 68585477, compound

Product 1

HCID 178421924HCID 178421924, compound

Sources & evidence

ORD record
ord-b812b298e55a439fb19ffd7811b29b23
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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