Pyrazole → HCID 178428071, compound

HRID 679557Notes

Reaction equation

HRID 679557 reaction equation
[C:12](#[N:13])[C:14]1([NH:17][C:18](=[O:19])[CH:20]2[N:21]([c:39]3[n:40]([CH:45]4[CH2:46][CH2:47][CH2:48]4)[n:41][c:42]([CH3:44])[cH:43]3)[CH2:22][CH:23]([S:25](=[O:26])(=[O:27])[c:28]3[c:29]([C:35]([F:36])([F:37])[F:38])[cH:30][c:31]([F:34])[cH:32][cH:33]3)[CH2:24]2)[CH2:15][CH2:16]1.[C:6](=[O:7])([O-:8])[O-:9].[Cs+:10].[Cs+:11].[nH:1]1[n:2][cH:3][cH:4][cH:5]1>>[n:1]1(-[c:31]2[cH:30][c:29]([C:35]([F:36])([F:37])[F:38])[c:28]([S:25]([CH:23]3[CH2:22][N:21]([c:39]4[n:40]([CH:45]5[CH2:46][CH2:47][CH2:48]5)[n:41][c:42]([CH3:44])[cH:43]4)[CH:20]([C:18]([NH:17][C:14]4([C:12]#[N:13])[CH2:15][CH2:16]4)=[O:19])[CH2:24]3)(=[O:26])=[O:27])[cH:33][cH:32]2)[n:2][cH:3][cH:4][cH:5]1

Participants

5

Reactant 4

HCID 1048PyrazoleHCID 19660Carbonate IonHCID 104967Cesium cation2×HCID 178428063HCID 178428063, compound

Product 1

HCID 178428071HCID 178428071, compound

Sources & evidence

ORD record
ord-d9bf092b8e2e46de95bc87827caf32c8
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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