Ethyl Acetate → HCID 25013661, compound

HRID 1130811Notes

Reaction equation

HRID 1130811 reaction equation
[C:21](=[O:22])([O-:23])[O-:24].[CH3:35][N:36]1[CH2:37][CH2:38][CH2:39][C:40]1=[O:41].[CH3:42][CH2:43][O:44][C:45](=[O:46])[CH3:47].[Cl:27][c:28]1[n:29][cH:30][c:31]([F:34])[cH:32][n:33]1.[Cs+:25].[Cs+:26].[F:1][c:2]1[c:3]([N:9]2[CH2:10][CH2:11][CH:12]([CH:15]3[CH2:16][CH2:17][NH:18][CH2:19][CH2:20]3)[CH2:13][CH2:14]2)[n:4][c:5]([CH3:8])[n:6][cH:7]1>>[F:1][c:2]1[c:3]([N:9]2[CH2:10][CH2:11][CH:12]([CH:15]3[CH2:16][CH2:17][N:18]([c:28]4[n:29][cH:30][c:31]([F:34])[cH:32][n:33]4)[CH2:19][CH2:20]3)[CH2:13][CH2:14]2)[n:4][c:5]([CH3:8])[n:6][cH:7]1

Participants

7

Reactant 6

HCID 8857Ethyl AcetateHCID 13387N-methyl-2-pyrrolidoneHCID 19660Carbonate IonHCID 104967Cesium cation2×HCID 5834662-Chloro-5-fluoropyrimidineHCID 59178900HCID 59178900, compound

Product 1

HCID 25013661HCID 25013661, compound

Sources & evidence

ORD record
ord-38c87ee15e814134a35f4cc67a42689e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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