Acetonitrile → HCID 23659124, compound

HRID 291225Notes

Reaction equation

HRID 291225 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.[CH2:25]([CH3:26])[NH:27][CH2:28][CH3:29].[CH3:30][N:31]([c:32]1[cH:33][cH:34][n:35][cH:36][cH:37]1)[CH3:38].[CH3:39][C:40]#[N:41].[CH3:42][CH2:43][O:44][C:45]([CH3:46])=[O:47]>>[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:27]([CH2:25][CH3:26])[CH2:28][CH3:29])[cH:20]2

Participants

6

Reactant 5

HCID 6342AcetonitrileHCID 8021DiethylamineHCID 8857Ethyl AcetateHCID 142844-(Dimethylamino)pyridineHCID 579372982-tert-Butyl-1-(tetrahydro-2H-pyran-4-ylmethyl)-1H-benzimidazole-5-sulfonyl chloride

Product 1

HCID 23659124HCID 23659124, compound

Sources & evidence

ORD record
ord-c5988be1185145d499b82eb38a953e1a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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