Acetonitrile → HCID 19854909, compound

HRID 1135983Notes

Reaction equation

HRID 1135983 reaction equation
[CH3:1][c:2]1[c:3]([NH:18][C:19](=[S:20])[NH:21][C:22]([CH3:23])([CH3:24])[CH3:25])[c:4]([CH3:17])[cH:5][c:6]([O:8][c:9]2[n:10][cH:11][c:12]([Cl:16])[cH:13][c:14]2[Cl:15])[cH:7]1.[CH3:35][CH2:36][N:37]([CH2:38][CH3:39])[CH2:40][CH3:41].[CH3:42][C:43]#[N:44].[Cl:27][c:28]1[cH:29][cH:30][cH:31][cH:32][n+:33]1[CH3:34].[I-:26]>>[CH3:1][c:2]1[c:3]([N:18]=[C:19]=[N:21][C:22]([CH3:23])([CH3:24])[CH3:25])[c:4]([CH3:17])[cH:5][c:6]([O:8][c:9]2[n:10][cH:11][c:12]([Cl:16])[cH:13][c:14]2[Cl:15])[cH:7]1

Participants

6

Reactant 5

HCID 6342AcetonitrileHCID 8471TriethylamineHCID 30165Iodide IonHCID 1670702-Chloro-1-methylpyridiniumHCID 19854910HCID 19854910, compound

Product 1

HCID 19854909HCID 19854909, compound

Sources & evidence

ORD record
ord-6500a1f9cf404cf09a530a11a65d5681
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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