Acetonitrile → HCID 68536464, compound

HRID 2131326Notes

Reaction equation

HRID 2131326 reaction equation
[CH3:27][N:28]1[CH2:29][CH2:30][NH:31][CH2:32][CH2:33]1.[CH3:34][C:35]#[N:36].[CH3:37][CH2:38][O:39][C:40](=[O:41])[CH3:42].[F:1][c:2]1[c:3]([CH:9]=[CH:10][c:11]2[n:12][cH:13][c:14]([S:17](=[O:18])(=[O:19])[c:20]3[c:21]([F:26])[cH:22][cH:23][cH:24][cH:25]3)[cH:15][cH:16]2)[cH:4][cH:5][c:6]([F:8])[cH:7]1>>[F:1][c:2]1[c:3]([CH:9]=[CH:10][c:11]2[n:12][cH:13][c:14]([S:17](=[O:18])(=[O:19])[c:20]3[c:21]([N:31]4[CH2:30][CH2:29][N:28]([CH3:27])[CH2:33][CH2:32]4)[cH:22][cH:23][cH:24][cH:25]3)[cH:15][cH:16]2)[cH:4][cH:5][c:6]([F:8])[cH:7]1

Participants

5

Reactant 4

HCID 6342AcetonitrileHCID 8857Ethyl AcetateHCID 531671-MethylpiperazineHCID 68530611HCID 68530611, compound

Product 1

HCID 68536464HCID 68536464, compound

Sources & evidence

ORD record
ord-b0a82ed6c65b40649cd36dc63b58e621
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

Loading…