Water → HCID 54140032, compound

HRID 1538764Notes

Reaction equation

HRID 1538764 reaction equation
[CH2:9]([Li:10])[CH2:11][CH2:12][CH3:13].[CH3:1][C:2]#[N:3].[CH3:35][CH2:36][O:37][C:38](=[O:39])[CH3:40].[CH:14]([CH3:15])([CH3:16])[n:17]1[c:18]([NH2:34])[n:19][c:20]2[c:21]1[cH:22][c:23]([C:26]([c:27]1[cH:28][cH:29][cH:30][cH:31][cH:32]1)=[O:33])[cH:24][cH:25]2.[O:4]1[CH2:5][CH2:6][CH2:7][CH2:8]1.[OH2:41]>>[CH:1]([C:2]#[N:3])=[C:26]([c:23]1[cH:22][c:21]2[n:17]([CH:14]([CH3:15])[CH3:16])[c:18]([NH2:34])[n:19][c:20]2[cH:25][cH:24]1)[c:27]1[cH:28][cH:29][cH:30][cH:31][cH:32]1

Participants

7

Reactant 6

HCID 962WaterHCID 6342AcetonitrileHCID 8028TetrahydrofuranHCID 8857Ethyl AcetateHCID 20432643HCID 20432643, compoundHCID 178418339Butyllithium

Product 1

HCID 54140032HCID 54140032, compound

Sources & evidence

ORD record
ord-06b207e383d14f238051f4a70f55bfe5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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