Dimethyl Sulfoxide → HCID 20331475, compound

HRID 2313603Notes

Reaction equation

HRID 2313603 reaction equation
[CH2:12]([CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH3:27])[N:28]([CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:36][CH2:37][CH2:38][CH2:39][CH2:40][CH2:41][CH2:42][CH2:43][CH3:44])[CH2:45][c:46]1[cH:47][c:48]([CH:49]=[O:50])[cH:51][cH:52][cH:53]1.[CH3:3][S:4]([CH3:5])=[O:6].[CH3:8][S+:9]([CH3:10])[CH3:11].[H-:1].[I-:7].[Na+:2].[O:54]1[CH2:55][CH2:56][CH2:57][CH2:58]1.[OH2:59]>>[CH2:8]1[CH:49]([c:48]2[cH:47][c:46]([CH2:45][N:28]([CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH3:27])[CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:36][CH2:37][CH2:38][CH2:39][CH2:40][CH2:41][CH2:42][CH2:43][CH3:44])[cH:53][cH:52][cH:51]2)[O:50]1

Participants

9

Reactant 8

HCID 679Dimethyl SulfoxideHCID 923Sodium ionHCID 962WaterHCID 1147TrimethylsulfoniumHCID 8028TetrahydrofuranHCID 30165Iodide IonHCID 166653HydrideHCID 20331478HCID 20331478, compound

Product 1

HCID 20331475HCID 20331475, compound

Sources & evidence

ORD record
ord-db2baf441ab44729ab9f3ca4556795e1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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