Acetonitrile → 6-Bromo-4'-methyl-2-(tetrahydro-2H-pyran-3-yl)spiro[chroman-4,2'-imidazole]5'(1'H)-thione

HRID 206099Notes

Reaction equation

HRID 206099 reaction equation
[Br:1][c:2]1[cH:3][c:4]2[c:9]([cH:10][cH:11]1)[O:8][CH:7]([CH:12]1[CH2:13][O:14][CH2:15][CH2:16][CH2:17]1)[CH2:6][C:5]2=[N:18][S:19]([C:20]([CH3:21])([CH3:22])[CH3:23])=[O:24].[CH3:31][C:32]#[N:33].[O:25]=[C:26]([C:27]([NH2:28])=[S:29])[CH3:30]>>[Br:1][c:2]1[cH:3][c:4]2[c:9]([cH:10][cH:11]1)[O:8][CH:7]([CH:12]1[CH2:13][O:14][CH2:15][CH2:16][CH2:17]1)[CH2:6][C:5]21[N:18]=[C:26]([CH3:30])[C:27](=[S:29])[NH:28]1

Participants

4

Reactant 3

HCID 6342AcetonitrileHCID 207652372-OxopropanethioamideHCID 67979529N-(6-Bromo-2-(tetrahydro-2H-pyran-3-yl)chroman-4-ylidene)-2-methylpropane-2-sulfinamide

Product 1

HCID 866672776-Bromo-4'-methyl-2-(tetrahydro-2H-pyran-3-yl)spiro[chroman-4,2'-imidazole]5'(1'H)-thione

Sources & evidence

ORD record
ord-73014b588a9145a0ac16ae36b70667d1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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