Acetonitrile → HCID 22633008, compound

HRID 1545224Notes

Reaction equation

HRID 1545224 reaction equation
[CH2:1]1[CH2:2][CH2:3][NH:4][CH2:5]1.[CH2:6]([c:7]1[cH:8][cH:9][cH:10][cH:11][cH:12]1)[O:13][n:14]1[c:15](=[O:34])[n:16](-[c:27]2[c:28]([F:33])[cH:29][cH:30][cH:31][cH:32]2)[c:17]2[c:18]([c:19]1=[O:20])[cH:21][c:22]([F:26])[c:23]([Cl:25])[n:24]2.[CH3:35][CH2:36][N:37]([CH2:38][CH3:39])[CH2:40][CH3:41].[CH3:42][C:43]#[N:44]>>[CH2:1]1[CH2:2][CH2:3][N:4]([c:23]2[c:22]([F:26])[cH:21][c:18]3[c:17]([n:16](-[c:27]4[c:28]([F:33])[cH:29][cH:30][cH:31][cH:32]4)[c:15](=[O:34])[n:14]([O:13][CH2:6][c:7]4[cH:8][cH:9][cH:10][cH:11][cH:12]4)[c:19]3=[O:20])[n:24]2)[CH2:5]1

Participants

5

Reactant 4

HCID 6342AcetonitrileHCID 8471TriethylamineHCID 31268PyrrolidineHCID 22632952HCID 22632952, compound

Product 1

HCID 22633008HCID 22633008, compound

Sources & evidence

ORD record
ord-8ca5d99a0afd4cdfb33efdb88d5e7262
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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