Acetonitrile → HCID 66739019, compound

HRID 193505Notes

Reaction equation

HRID 193505 reaction equation
[Br:1][c:2]1[cH:3][cH:4][cH:5][c:6]2[c:7]([CH2:20][CH2:21][CH2:22][C:23](=[O:24])[O:25][CH2:26][CH3:27])[c:8]([CH3:19])[n:9]([CH2:11][CH2:12][CH2:13][C:14](=[O:15])[O:16][CH2:17][CH3:18])[c:10]12.[C:28]([CH3:29])(=[O:30])[O:31][c:32]1[cH:33][cH:34][c:35]([C:38]#[CH:39])[cH:36][cH:37]1.[CH3:40][C:41]#[N:42].[CH:43]([NH:44][CH:45]([CH3:46])[CH3:47])([CH3:48])[CH3:49]>>[c:2]1([C:39]#[C:38][c:35]2[cH:34][cH:33][c:32]([O:31][C:28]([CH3:29])=[O:30])[cH:37][cH:36]2)[cH:3][cH:4][cH:5][c:6]2[c:7]([CH2:20][CH2:21][CH2:22][C:23](=[O:24])[O:25][CH2:26][CH3:27])[c:8]([CH3:19])[n:9]([CH2:11][CH2:12][CH2:13][C:14](=[O:15])[O:16][CH2:17][CH3:18])[c:10]12

Participants

5

Reactant 4

HCID 6342AcetonitrileHCID 7912DiisopropylamineHCID 117895014-Ethynylphenyl acetateHCID 66739194Ethyl 4-[7-bromo-1-(4-ethoxy-4-oxobutyl)-2-methylindol-3-yl]butanoate

Product 1

HCID 66739019HCID 66739019, compound

Sources & evidence

ORD record
ord-2dadd59da7fa414e89f424567fc52df7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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