Acetonitrile → 1-{[2-(1,1-dimethylpropyl)-1-(tetrahydro-2H-pyran-4-ylmethyl)-1H-benzimidazol-5-yl]sulfonyl}-1H-pyrazole-4-carbaldehyde

HRID 213075Notes

Reaction equation

HRID 213075 reaction equation
[CH3:1][C:2]([CH2:3][CH3:4])([CH3:5])[c:6]1[n:7][c:8]2[c:9]([n:10]1[CH2:11][CH:12]1[CH2:13][CH2:14][O:15][CH2:16][CH2:17]1)[cH:18][cH:19][c:20]([S:22](=[O:23])(=[O:24])[Cl:25])[cH:21]2.[CH3:33][N:34]([c:35]1[cH:36][cH:37][n:38][cH:39][cH:40]1)[CH3:41].[CH3:42][C:43]#[N:44].[nH:26]1[n:27][cH:28][c:29]([CH:31]=[O:32])[cH:30]1>>[CH3:1][C:2]([CH2:3][CH3:4])([CH3:5])[c:6]1[n:7][c:8]2[c:9]([n:10]1[CH2:11][CH:12]1[CH2:13][CH2:14][O:15][CH2:16][CH2:17]1)[cH:18][cH:19][c:20]([S:22](=[O:23])(=[O:24])[n:26]1[n:27][cH:28][c:29]([CH:31]=[O:32])[cH:30]1)[cH:21]2

Participants

5

Reactant 4

HCID 6342AcetonitrileHCID 142844-(Dimethylamino)pyridineHCID 51306731H-pyrazole-4-carbaldehydeHCID 579373072-tert-pentyl-1-((tetrahydro-2H-pyran-4-yl)methyl)-1H-benzo[d]imidazole-5-sulfonyl chloride

Product 1

HCID 579373411-{[2-(1,1-dimethylpropyl)-1-(tetrahydro-2H-pyran-4-ylmethyl)-1H-benzimidazol-5-yl]sulfonyl}-1H-pyrazole-4-carbaldehyde

Sources & evidence

ORD record
ord-abac8b3523ef4818a4dd832496923f26
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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