Acetonitrile → HCID 57579036, compound

HRID 1547827Notes

Reaction equation

HRID 1547827 reaction equation
[Br:25][N:26]1[C:27](=[O:28])[CH2:32][CH2:31][C:29]1=[O:30].[CH3:33][C:34]#[N:35].[CH3:36][CH2:37][O:38][C:39](=[O:40])[CH3:41].[NH2:1][c:2]1[c:3]2[n:4][cH:5][n:6]([CH2:16][c:17]3[cH:18][c:19]([C:20]#[N:21])[cH:22][cH:23][cH:24]3)[c:7]2[n:8][c:9]([O:11][CH2:12][CH2:13][O:14][CH3:15])[n:10]1>>[NH2:1][c:2]1[c:3]2[n:4][c:5]([O:28][CH3:27])[n:6]([CH2:16][c:17]3[cH:18][c:19]([C:20]#[N:21])[cH:22][cH:23][cH:24]3)[c:7]2[n:8][c:9]([O:11][CH2:12][CH2:13][O:14][CH3:15])[n:10]1

Participants

5

Reactant 4

HCID 6342AcetonitrileHCID 8857Ethyl AcetateHCID 67184N-bromobutanimideHCID 57579059HCID 57579059, compound

Product 1

HCID 57579036HCID 57579036, compound

Sources & evidence

ORD record
ord-e55af5884e9245cda5e07386f937defe
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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