Potassium Cation → HCID 20385547, compound

HRID 2138716Notes

Reaction equation

HRID 2138716 reaction equation
[CH3:43][CH:44]([CH3:45])[CH2:46][C:47](=[O:48])[CH3:49].[Cl:15][c:16]1[c:17]([CH3:33])[cH:18][c:19]([N:22]2[CH2:23][NH:24][C:25](=[O:32])[C:26]23[CH2:27][CH2:28][NH:29][CH2:30][CH2:31]3)[cH:20][cH:21]1.[Cl:1][CH2:2][CH2:3][CH2:4][n:5]1[c:6](=[O:14])[nH:7][c:8]2[c:9]1[cH:10][cH:11][cH:12][cH:13]2.[I-:41].[K+:40].[Na+:34].[Na+:35].[O-:36][C:37](=[O:38])[O-:39].[OH2:42]>>[CH2:2]([CH2:3][CH2:4][n:5]1[c:6](=[O:14])[nH:7][c:8]2[c:9]1[cH:10][cH:11][cH:12][cH:13]2)[N:29]1[CH2:28][CH2:27][C:26]2([N:22]([c:19]3[cH:18][c:17]([CH3:33])[c:16]([Cl:15])[cH:21][cH:20]3)[CH2:23][NH:24][C:25]2=[O:32])[CH2:31][CH2:30]1

Participants

9

Reactant 8

HCID 813Potassium CationHCID 923Sodium ion2×HCID 962WaterHCID 7909Methyl Isobutyl KetoneHCID 19660Carbonate IonHCID 30165Iodide IonHCID 18104191-(3-chloropropyl)-1,3-dihydro-2H-benzimidazol-2-oneHCID 203856051-(4-Chloro-3-methylphenyl)-1,3,8-triazaspiro[4,5]decan-4-one

Product 1

HCID 20385547HCID 20385547, compound

Sources & evidence

ORD record
ord-d79639b0bd964ca68cb267104200583a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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