Carbonate Ion → HCID 58255026, compound

HRID 2321962Notes

Reaction equation

HRID 2321962 reaction equation
[C:38](=[O:39])([O-:40])[O-:41].[Cl:1][c:2]1[c:3]([NH:23][c:24]2[n:25][nH:26][c:27]([CH3:29])[cH:28]2)[n:4][c:5]([NH:8][c:9]2[c:10]([F:22])[cH:11][c:12]([CH:16]3[CH2:17][CH2:18][NH:19][CH2:20][CH2:21]3)[c:13]([CH3:15])[cH:14]2)[n:6][cH:7]1.[Cl:30][c:31]1[n:32][n:33][c:34]([CH3:37])[cH:35][cH:36]1.[Cs+:42].[Cs+:43].[O:44]1[CH2:45][CH2:46][O:47][CH2:48][CH2:49]1>>[Cl:1][c:2]1[c:3]([NH:23][c:24]2[n:25][nH:26][c:27]([CH3:29])[cH:28]2)[n:4][c:5]([NH:8][c:9]2[c:10]([F:22])[cH:11][c:12]([CH:16]3[CH2:17][CH2:18][N:19]([c:31]4[n:32][n:33][c:34]([CH3:37])[cH:35][cH:36]4)[CH2:20][CH2:21]3)[c:13]([CH3:15])[cH:14]2)[n:6][cH:7]1

Participants

6

Reactant 5

HCID 19660Carbonate IonHCID 312751,4-DioxaneHCID 104967Cesium cation2×HCID 2272543-Chloro-6-methylpyridazineHCID 446126165-chloro-N2-(2-fluoro-5-methyl-4-(piperidin-4-yl)phenyl)-N4-(5-methyl-1H-pyrazol-3-yl)pyrimidine-2,4-diamine

Product 1

HCID 58255026HCID 58255026, compound

Sources & evidence

ORD record
ord-c90402c1b988420fb8aa81c30e474609
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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