Acetonitrile → HCID 178426154, compound

HRID 285241Notes

Reaction equation

HRID 285241 reaction equation
[CH3:1][S:2]([O:3][CH:6]1[CH2:7][N:8]([c:11]2[s:12][c:13]3[c:14]([n:15]2)[cH:16][cH:17][c:18](-[c:20]2[cH:21][cH:22][c:23]([C:26]#[N:27])[cH:24][cH:25]2)[cH:19]3)[CH2:9][CH2:10]1)(=[O:4])=[O:5].[CH3:28][CH:29]1[NH:30][CH2:31][CH2:32][CH2:33]1.[CH3:43][C:44]#[N:45].[CH:34]([N:35]([CH2:36][CH3:37])[CH:38]([CH3:39])[CH3:40])([CH3:41])[CH3:42]>>[CH:6]1([N:30]2[CH:29]([CH3:28])[CH2:33][CH2:32][CH2:31]2)[CH2:7][N:8]([c:11]2[s:12][c:13]3[c:14]([n:15]2)[cH:16][cH:17][c:18](-[c:20]2[cH:21][cH:22][c:23]([C:26]#[N:27])[cH:24][cH:25]2)[cH:19]3)[CH2:9][CH2:10]1

Participants

5

Reactant 4

HCID 6342AcetonitrileHCID 130032-MethylpyrrolidineHCID 81531DiisopropylethylamineHCID 87198666HCID 87198666, compound

Product 1

HCID 178426154HCID 178426154, compound

Sources & evidence

ORD record
ord-2fc97add5a98495baf253193d4aa6fe0
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

Loading…