Ethanol → 4-[7-[2-[2-(2,2-Dimethylpropoxy)-3-methoxyphenyl]ethenyl]-5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-6-yl]benzonitrile

HRID 2135014Notes

Reaction equation

HRID 2135014 reaction equation
[CH3:1][c:2]1[n:3][c:4]2[n:5]([c:6](=[O:16])[c:7]1-[c:8]1[cH:9][cH:10][c:11]([C:12]#[N:13])[cH:14][cH:15]1)[cH:17][cH:18][s:19]2.[CH3:20][O:21][c:22]1[c:23]([O:30][CH2:31][C:32]([CH3:33])([CH3:34])[CH3:35])[c:24]([CH:25]=[O:26])[cH:27][cH:28][cH:29]1.[CH3:37][CH2:38][O-:39].[CH3:40][CH2:41][OH:42].[Na+:36]>>[CH:1]([c:2]1[n:3][c:4]2[n:5]([c:6](=[O:16])[c:7]1-[c:8]1[cH:9][cH:10][c:11]([C:12]#[N:13])[cH:14][cH:15]1)[cH:17][cH:18][s:19]2)=[CH:25][c:24]1[c:23]([O:30][CH2:31][C:32]([CH3:33])([CH3:34])[CH3:35])[c:22]([O:21][CH3:20])[cH:29][cH:28][cH:27]1

Participants

6

Reactant 5

HCID 702EthanolHCID 923Sodium ionHCID 1194401-Hydroxyethyl radicalHCID 66752927HCID 66752927, compoundHCID 866360773-Methoxy-2-neopentyloxybenzaldehyde

Product 1

HCID 667529964-[7-[2-[2-(2,2-Dimethylpropoxy)-3-methoxyphenyl]ethenyl]-5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-6-yl]benzonitrile

Sources & evidence

ORD record
ord-40cbb273e9d44ad08ca93ba6854eb8dd
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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