Dimethylformamide → (RS)-S-[4-({5-bromo-4-[(RS)-(1-hydroxymethyl-propyl)sulfanyl]pyrimidin-2-yl}amino)phenyl]-S-methyl Sulfoximide

HRID 1227237Notes

Reaction equation

HRID 1227237 reaction equation
[Br:1][c:2]1[c:3]([Cl:19])[n:4][c:5]([NH:8][c:9]2[cH:10][cH:11][c:12]([S:15](=[O:16])(=[NH:17])[CH3:18])[cH:13][cH:14]2)[n:6][cH:7]1.[CH3:20][CH2:21][N:22]([CH2:23][CH3:24])[CH2:25][CH3:26].[CH3:33][N:34]([CH3:35])[CH:36]=[O:37].[SH:27][CH:28]([CH2:29][OH:30])[CH2:31][CH3:32]>>[Br:1][c:2]1[c:3]([S:27][CH:28]([CH2:29][OH:30])[CH2:31][CH3:32])[n:4][c:5]([NH:8][c:9]2[cH:10][cH:11][c:12]([S:15](=[O:16])(=[NH:17])[CH3:18])[cH:13][cH:14]2)[n:6][cH:7]1

Participants

5

Reactant 4

HCID 6228DimethylformamideHCID 8471TriethylamineHCID 14249190(RS)-2-mercapto-butan-1-olHCID 59674032(RS)-S-{4-[(5-bromo-4-chloropyrimidin-2-yl)amino]phenyl}-S-methyl sulfoximide

Product 1

HCID 59674013(RS)-S-[4-({5-bromo-4-[(RS)-(1-hydroxymethyl-propyl)sulfanyl]pyrimidin-2-yl}amino)phenyl]-S-methyl Sulfoximide

Sources & evidence

ORD record
ord-86456b92d0f84eb39f0d5eb1f3fbdda2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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