Dimethyl Sulfoxide → Chloride

HRID 2316506Notes

Reaction equation

HRID 2316506 reaction equation
[CH3:32][S:33]([CH3:34])=[O:35].[Cl:1][c:2]1[c:3]2[c:4]([n:5][cH:6][n:7]1)[nH:8][c:9]([C:11]1=[CH:16][CH2:15][N:14]([C:17](=[O:18])[O:19][C:20]([CH3:21])([CH3:22])[CH3:23])[CH2:13][CH2:12]1)[cH:10]2.[N:24]12[CH2:25][CH2:26][N:27]([CH2:28][CH2:29]1)[CH2:30][CH2:31]2>>[Cl-:1].[c:2]1([N+:24]23[CH2:25][CH2:26][N:27]([CH2:28][CH2:29]2)[CH2:30][CH2:31]3)[c:3]2[c:4]([n:5][cH:6][n:7]1)[nH:8][c:9]([C:11]1=[CH:16][CH2:15][N:14]([C:17](=[O:18])[O:19][C:20]([CH3:21])([CH3:22])[CH3:23])[CH2:13][CH2:12]1)[cH:10]2

Participants

5

Reactant 3

HCID 679Dimethyl SulfoxideHCID 9237DabcoHCID 58709797tert-butyl 4-(4-chloro-7H-pyrrolo[2,3-d]pyrimidin-6-yl)-3,6-dihydropyridine-1(2H)-carboxylate

Product 2

HCID 312ChlorideHCID 58709969HCID 58709969, compound

Sources & evidence

ORD record
ord-31037706b6ab44e69635796dc73df161
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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