Dimethyl Sulfoxide → HCID 178423782, compound

HRID 1120652Notes

Reaction equation

HRID 1120652 reaction equation
[CH3:41][S:42]([CH3:43])=[O:44].[Cl:19][c:20]1[c:21](-[c:26]2[n:27][c:28]3[c:29]([CH3:38])[cH:30][cH:31][cH:32][c:33]3[cH:34][c:35]2[CH2:36][OH:37])[cH:22][cH:23][cH:24][cH:25]1.[Cl:1][c:2]1[c:3]2[nH:4][cH:5][n:6][c:7]2[n:8][cH:9][n:10]1.[H-:39].[N:11]12[CH2:12][CH2:13][N:14]([CH2:15][CH2:16]1)[CH2:17][CH2:18]2.[Na+:40].[OH2:45]>>[c:2]1([O:37][CH2:36][c:35]2[c:26](-[c:21]3[c:20]([Cl:19])[cH:25][cH:24][cH:23][cH:22]3)[n:27][c:28]3[c:29]([CH3:38])[cH:30][cH:31][cH:32][c:33]3[cH:34]2)[c:3]2[n:4][cH:5][nH:6][c:7]2[n:8][cH:9][n:10]1

Participants

8

Reactant 7

HCID 679Dimethyl SulfoxideHCID 923Sodium ionHCID 962WaterHCID 9237DabcoHCID 166653HydrideHCID 53592776-ChloropurineHCID 57707772HCID 57707772, compound

Product 1

HCID 178423782HCID 178423782, compound

Sources & evidence

ORD record
ord-386e685ef9db480da6b3e85561d60947
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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