Acetonitrile → HCID 66733274, compound

HRID 1138597Notes

Reaction equation

HRID 1138597 reaction equation
[CH3:51][C:52]#[N:53].[O:1]=[C:2]1[N:3]([Br:8])[C:4](=[O:5])[CH2:6][CH2:7]1.[O:9]1[CH2:10][CH2:11][N:12]([c:15]2[n:16][c:17]3[n:18]([c:19]([N:21]([CH2:22][O:23][CH2:24][CH2:25][Si:26]([CH3:27])([CH3:28])[CH3:29])[CH2:30][O:31][CH2:32][CH2:33][Si:34]([CH3:35])([CH3:36])[CH3:37])[cH:20]2)[n:38][cH:39][c:40]3-[c:41]2[cH:42][n:43][c:44]3[cH:45][cH:46][cH:47][cH:48][c:49]3[cH:50]2)[CH2:13][CH2:14]1>>[Br:8][c:20]1[c:15]([N:12]2[CH2:11][CH2:10][O:9][CH2:14][CH2:13]2)[n:16][c:17]2[n:18]([c:19]1[N:21]([CH2:22][O:23][CH2:24][CH2:25][Si:26]([CH3:27])([CH3:28])[CH3:29])[CH2:30][O:31][CH2:32][CH2:33][Si:34]([CH3:35])([CH3:36])[CH3:37])[n:38][cH:39][c:40]2-[c:41]1[cH:42][n:43][c:44]2[cH:45][cH:46][cH:47][cH:48][c:49]2[cH:50]1

Participants

4

Reactant 3

HCID 6342AcetonitrileHCID 67184N-bromobutanimideHCID 66733517HCID 66733517, compound

Product 1

HCID 66733274HCID 66733274, compound

Sources & evidence

ORD record
ord-9545afdcdb9f4bb28af610ddc5422e1d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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