Acetonitrile → HCID 23659705, compound

HRID 1147624Notes

Reaction equation

HRID 1147624 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[n:6][c:7]2[c:8]([n:9]1[CH2:10][CH:11]1[CH2:12][CH2:13][O:14][CH2:15][CH2:16]1)[cH:17][cH:18][c:19]([S:21](=[O:22])(=[O:23])[Cl:24])[cH:20]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].[CH:25]1([NH:31][CH3:32])[CH2:26][CH2:27][CH2:28][CH2:29][CH2:30]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[n:6][c:7]2[c:8]([n:9]1[CH2:10][CH:11]1[CH2:12][CH2:13][O:14][CH2:15][CH2:16]1)[cH:17][cH:18][c:19]([S:21](=[O:22])(=[O:23])[N:31]([CH:25]1[CH2:26][CH2:27][CH2:28][CH2:29][CH2:30]1)[CH3:32])[cH:20]2

Participants

5

Reactant 4

HCID 6342AcetonitrileHCID 7514N-MethylcyclohexylamineHCID 142844-(Dimethylamino)pyridineHCID 579372982-tert-Butyl-1-(tetrahydro-2H-pyran-4-ylmethyl)-1H-benzimidazole-5-sulfonyl chloride

Product 1

HCID 23659705HCID 23659705, compound

Sources & evidence

ORD record
ord-0ffabca87b4d4a8b9b84987f752d6722
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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