Acetonitrile → HCID 86624201, compound

HRID 1124507Notes

Reaction equation

HRID 1124507 reaction equation
[CH2:18]([N:19]([CH:20]([CH3:21])[CH3:22])[CH:23]([CH3:24])[CH3:25])[CH3:26].[CH2:27]1[CH2:28][CH2:29][NH:30][CH2:31][CH2:32]1.[CH3:33][C:34]#[N:35].[Cl:1][c:2]1[n:3][c:4]([Cl:17])[c:5]2[c:6]([n:7]1)[c:8]([Cl:16])[cH:9][c:10]([C:12](=[O:13])[O:14][CH3:15])[n:11]2>>[Cl:1][c:2]1[n:3][c:4]([N:30]2[CH2:29][CH2:28][CH2:27][CH2:32][CH2:31]2)[c:5]2[c:6]([n:7]1)[c:8]([Cl:16])[cH:9][c:10]([C:12](=[O:13])[O:14][CH3:15])[n:11]2

Participants

5

Reactant 4

HCID 6342AcetonitrileHCID 8082PiperidineHCID 81531DiisopropylethylamineHCID 12472441HCID 12472441, compound

Product 1

HCID 86624201HCID 86624201, compound

Sources & evidence

ORD record
ord-198c3b37f084455d986a963b4e35b55a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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