Acetonitrile → L 697639

HRID 205466Notes

Reaction equation

[CH3:34][C:35]#[N:36].[CH:25]([N:26]([CH:27]([CH3:28])[CH3:29])[CH2:30][CH3:31])([CH3:32])[CH3:33].[Cl:12][CH2:13][c:14]1[o:15][c:16]2[c:17]([n:18]1)[c:19]([CH3:24])[cH:20][cH:21][c:22]2[CH3:23].[NH2:1][c:2]1[c:3](=[O:11])[nH:4][c:5]([CH3:10])[c:6]([CH2:8][CH3:9])[cH:7]1>>[NH:1]([c:2]1[c:3](=[O:11])[nH:4][c:5]([CH3:10])[c:6]([CH2:8][CH3:9])[cH:7]1)[CH2:13][c:14]1[o:15][c:16]2[c:17]([n:18]1)[c:19]([CH3:24])[cH:20][cH:21][c:22]2[CH3:23]

Participants

Reactant 4

HCID 6342Acetonitrile

HCID 81531Diisopropylethylamine

HCID 4810223-Amino-5-ethyl-6-methyl-1H-pyridin-2-one

HCID 100355622-Chloromethyl-4,7-dimethylbenzoxazole

Product 1

HCID 60832L 697639

Sources & evidence

ORD record: ord-640e6fa1de214280b06af660d73fb453
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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