Acetonitrile → HCID 178498749, compound

HRID 170726Notes

Reaction equation

HRID 170726 reaction equation
[C:22](=[O:23])([n:24]1[cH:25][cH:26][n:27][cH:28]1)[n:29]1[cH:30][cH:31][n:32][cH:33]1.[CH3:34][C:35]#[N:36].[N:1]1([c:6]2[c:7]([F:21])[cH:8][c:9]([NH:13][CH2:14][CH:15]([C:16](=[O:17])[O:18][CH3:19])[OH:20])[cH:10][c:11]2[F:12])[CH2:2][CH:3]=[CH:4][CH2:5]1>>[N:1]1([c:6]2[c:7]([F:21])[cH:8][c:9]([N:13]3[CH2:14][CH:15]([C:16](=[O:17])[O:18][CH3:19])[O:20][C:22]3=[O:23])[cH:10][c:11]2[F:12])[CH2:2][CH:3]=[CH:4][CH2:5]1

Participants

4

Reactant 3

HCID 6342AcetonitrileHCID 682631,1'-CarbonyldiimidazoleHCID 178501842HCID 178501842, compound

Product 1

HCID 178498749HCID 178498749, compound

Sources & evidence

ORD record
ord-ee50df938af14cf591b2b927ff712cf7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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