Acetonitrile → HCID 57937350, compound

HRID 1130489Notes

Reaction equation

HRID 1130489 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.[CH3:36][N:37]([c:38]1[cH:39][cH:40][n:41][cH:42][cH:43]1)[CH3:44].[CH3:45][C:46]#[N:47].[NH:25]1[CH2:26][CH:27]([C:31](=[O:32])[O:33][CH2:34][CH3:35])[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:25]1[CH2:26][CH:27]([C:31](=[O:32])[O:33][CH2:34][CH3:35])[CH2:28][CH2:29][CH2:30]1)[cH:20]2

Participants

5

Reactant 4

HCID 6342AcetonitrileHCID 142844-(Dimethylamino)pyridineHCID 98969Ethyl nipecotateHCID 579372982-tert-Butyl-1-(tetrahydro-2H-pyran-4-ylmethyl)-1H-benzimidazole-5-sulfonyl chloride

Product 1

HCID 57937350HCID 57937350, compound

Sources & evidence

ORD record
ord-37f57c6a83724d31a0879bd423471cfb
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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