Hydroxide → 4-[3-Hydroxy-4-(1,1,4-trioxo-1,2,5-thiadiazolidin-2-yl)-phenyl]-3,3-dimethylbutyronitrile

HRID 112027Notes

Reaction equation

HRID 112027 reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][c:11]([CH2:23][C:24]([CH2:25][C:26]#[N:27])([CH3:28])[CH3:29])[cH:12][cH:13][c:14]1[N:15]1[S:16](=[O:21])(=[O:22])[NH:17][C:18](=[O:20])[CH2:19]1.[CH3:30][CH2:31][O:32][C:33]([CH3:34])=[O:35].[OH-:36].[OH-:37].[Pd+2:38]>>[OH:8][c:9]1[cH:10][c:11]([CH2:23][C:24]([CH2:25][C:26]#[N:27])([CH3:28])[CH3:29])[cH:12][cH:13][c:14]1[N:15]1[S:16](=[O:21])(=[O:22])[NH:17][C:18](=[O:20])[CH2:19]1

Participants

5

Reactant 4

HCID 961Hydroxide2×HCID 8857Ethyl AcetateHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 688387924-[3-Benzyloxy-4-(1,1,4-trioxo-1,2,5-thiadiazolidin-2-yl)-phenyl]-3,3-dimethylbutyronitrile

Product 1

HCID 577774334-[3-Hydroxy-4-(1,1,4-trioxo-1,2,5-thiadiazolidin-2-yl)-phenyl]-3,3-dimethylbutyronitrile

Sources & evidence

ORD record
ord-f5470053f5fb4bd7bab81e162b373766
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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