Carbonate Ion → HCID 59278563, compound

HRID 1558978Notes

Reaction equation

HRID 1558978 reaction equation
[C:48](=[O:49])([O-:50])[O-:51].[CH3:37][S:38]([O:39][CH2:42][CH2:43][C:44]1([OH:47])[CH2:45][CH2:46]1)(=[O:40])=[O:41].[CH3:54][N:55]([CH3:56])[C:57](=[O:58])[CH3:59].[Cs+:52].[Cs+:53].[F:1][c:2]1[cH:3][c:4]([NH:20][C:21](=[O:22])[c:23]2[c:24](=[O:36])[n:25](-[c:30]3[cH:31][cH:32][cH:33][cH:34][cH:35]3)[n:26]([CH3:29])[c:27]2[CH3:28])[cH:5][cH:6][c:7]1[O:8][c:9]1[cH:10][cH:11][n:12][c:13]2[cH:14][c:15]([OH:19])[cH:16][cH:17][c:18]12>>[F:1][c:2]1[cH:3][c:4]([NH:20][C:21](=[O:22])[c:23]2[c:24](=[O:36])[n:25](-[c:30]3[cH:31][cH:32][cH:33][cH:34][cH:35]3)[n:26]([CH3:29])[c:27]2[CH3:28])[cH:5][cH:6][c:7]1[O:8][c:9]1[cH:10][cH:11][n:12][c:13]2[cH:14][c:15]([O:19][CH2:42][CH2:43][C:44]3([OH:47])[CH2:45][CH2:46]3)[cH:16][cH:17][c:18]12

Participants

6

Reactant 5

HCID 19660Carbonate IonHCID 31374DimethylacetamideHCID 104967Cesium cation2×HCID 866407922-(1-Hydroxycyclopropyl)ethyl methanesulfonateHCID 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 59278563HCID 59278563, compound

Sources & evidence

ORD record
ord-64e1b9adb81340a8824a29c7537b03a2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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