Sodium ion → HCID 14727018, compound

HRID 2125957Notes

Reaction equation

HRID 2125957 reaction equation
[CH3:40][CH2:41][O:42][C:43](=[O:44])[CH3:45].[CH3:46][C:47]([CH2:48][CH:49]([CH3:50])[CH3:51])=[O:52].[Cl:1][CH2:2][CH2:3][CH2:4][CH2:5][c:6]1[cH:7][cH:8][c:9](-[c:12]2[n:13][n:14][s:15][cH:16]2)[cH:10][cH:11]1.[I-:39].[Na+:32].[Na+:33].[Na+:38].[O-:34][C:35](=[O:36])[O-:37].[s:17]1[n:18][c:19]([N:26]2[CH2:27][CH2:28][NH:29][CH2:30][CH2:31]2)[c:20]2[c:21]1[cH:22][cH:23][cH:24][cH:25]2>>[CH2:2]([CH2:3][CH2:4][CH2:5][c:6]1[cH:7][cH:8][c:9](-[c:12]2[n:13][n:14][s:15][cH:16]2)[cH:10][cH:11]1)[N:29]1[CH2:28][CH2:27][N:26]([c:19]2[n:18][s:17][c:21]3[c:20]2[cH:25][cH:24][cH:23][cH:22]3)[CH2:31][CH2:30]1

Participants

8

Reactant 7

HCID 923Sodium ion3×HCID 7909Methyl Isobutyl KetoneHCID 8857Ethyl AcetateHCID 19660Carbonate IonHCID 30165Iodide IonHCID 27721443-(1-Piperazinyl)-1,2-benzisothiazoleHCID 19872068HCID 19872068, compound

Product 1

HCID 14727018HCID 14727018, compound

Sources & evidence

ORD record
ord-e1fb6a8ca4c947d784c938707f869d77
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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