Carbonate Ion → HCID 46201941, compound

HRID 108726Notes

Reaction equation

HRID 108726 reaction equation
[C:49](=[O:50])([O-:51])[O-:52].[CH2:1]1[CH2:2][C:3]12[O:4][CH2:5][CH:6]([CH2:8][S:9]([O-:10])(=[O:11])=[O:12])[CH2:7]2.[Cs+:53].[Cs+:54].[OH:13][c:14]1[cH:15][cH:16][c:17]2[c:18]([O:24][c:25]3[c:26]([F:48])[cH:27][c:28]([NH:31][C:32](=[O:33])[c:34]4[c:35](=[O:47])[n:36](-[c:41]5[cH:42][cH:43][cH:44][cH:45][cH:46]5)[n:37]([CH3:40])[c:38]4[CH3:39])[cH:29][cH:30]3)[cH:19][cH:20][n:21][c:22]2[cH:23]1>>[CH2:1]1[CH2:2][C:3]12[O:4][CH2:5][CH:6]([O:13][c:14]1[cH:15][cH:16][c:17]3[c:18]([O:24][c:25]4[c:26]([F:48])[cH:27][c:28]([NH:31][C:32](=[O:33])[c:34]5[c:35](=[O:47])[n:36](-[c:41]6[cH:42][cH:43][cH:44][cH:45][cH:46]6)[n:37]([CH3:40])[c:38]5[CH3:39])[cH:29][cH:30]4)[cH:19][cH:20][n:21][c:22]3[cH:23]1)[CH2:7]2

Participants

5

Reactant 4

HCID 19660Carbonate IonHCID 104967Cesium cation2×HCID 86640794HCID 86640794, compoundHCID 136347997N-(3-fluoro-4-((7-hydroxyquinolin-4-yl)oxy)phenyl)-1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazole-4-carboxamide

Product 1

HCID 46201941HCID 46201941, compound

Sources & evidence

ORD record
ord-929855ded159480fa41d9ee36cb12744
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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