Potassium Cation → Dicyclohexylamine

HRID 159237Notes

Reaction equation

HRID 159237 reaction equation
[Br:7][CH2:8][CH:9]([C:10](=[O:11])[N:12]1[CH2:13][S:14][CH2:15][CH:16]1[C:17](=[O:18])[OH:19])[CH3:20].[C:1](=[O:2])([O-:3])[O-:4].[CH:36]1([NH:42][CH:43]2[CH2:44][CH2:45][CH2:46][CH2:47][CH2:48]2)[CH2:37][CH2:38][CH2:39][CH2:40][CH2:41]1.[Cl:21][c:22]1[c:23]([S:31]([NH2:32])(=[O:33])=[O:34])[cH:24][c:25]([C:26](=[S:27])[O-:28])[cH:29][cH:30]1.[K+:35].[K+:5].[K+:6].[OH2:49]>>[CH2:8]([CH:9]([C:10](=[O:11])[N:12]1[CH2:13][S:14][CH2:15][CH:16]1[C:17](=[O:18])[OH:19])[CH3:20])[S:27][C:26]([c:25]1[cH:24][c:23]([S:31]([NH2:32])(=[O:33])=[O:34])[c:22]([Cl:21])[cH:30][cH:29]1)=[O:28].[CH:36]1([NH:42][CH:43]2[CH2:44][CH2:45][CH2:46][CH2:47][CH2:48]2)[CH2:37][CH2:38][CH2:39][CH2:40][CH2:41]1

Participants

8

Reactant 6

HCID 813Potassium Cation3×HCID 962WaterHCID 7582DicyclohexylamineHCID 19660Carbonate IonHCID 155723743-(3-Bromo-2-methylpropanoyl)-1,3-thiazolidine-4-carboxylic acidHCID 178514756HCID 178514756, compound

Product 2

HCID 7582DicyclohexylamineHCID 178460873HCID 178460873, compound

Sources & evidence

ORD record
ord-482f9fc3da834d1a98248205674f7ba8
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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