Potassium Cation → HCID 11989542, compound

HRID 1118447Notes

Reaction equation

HRID 1118447 reaction equation
[CH3:46][CH2:47][O:48][C:49](=[O:50])[CH3:51].[Cl:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[c:9](-[c:18]3[cH:19][cH:20][c:21]([Cl:24])[cH:22][cH:23]3)[c:10]3[n:11]([n:12][cH:13]2)[c:14](=[O:17])[nH:15][n:16]3)[cH:6][cH:7]1.[K+:35].[K+:36].[O-:37][C:38]([O-:39])=[O:40].[O:25]1[CH:26]([CH2:27][c:28]2[cH:29][cH:30][cH:31][cH:32][cH:33]2)[CH2:34]1.[O:41]=[CH:42][N:43]([CH3:44])[CH3:45]>>[Cl:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[c:9](-[c:18]3[cH:19][cH:20][c:21]([Cl:24])[cH:22][cH:23]3)[c:10]3[n:11]([n:12][cH:13]2)[c:14](=[O:17])[n:15]([CH2:34][CH:26]([OH:25])[CH2:27][c:28]2[cH:29][cH:30][cH:31][cH:32][cH:33]2)[n:16]3)[cH:6][cH:7]1

Participants

7

Reactant 6

HCID 813Potassium Cation2×HCID 6228DimethylformamideHCID 8857Ethyl AcetateHCID 19660Carbonate IonHCID 948262-(Phenylmethyl)oxiraneHCID 111641617,8-bis(4-chlorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-3(2H)-one

Product 1

HCID 11989542HCID 11989542, compound

Sources & evidence

ORD record
ord-b1594b53cbd343ddafbee74b21109b12
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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