Potassium Cation → Ethyl 2-[(2-amino-1,3-thiazol-5-yl)sulfanyl]-2-methylpropanoate

HRID 175438Notes

Reaction equation

HRID 175438 reaction equation
[CH2:18]([CH3:19])[O:20][C:21]([C:22]([CH3:23])([CH3:24])[Br:25])=[O:26].[CH3:33][OH:34].[CH3:35][CH2:36][O:37][C:38]([CH3:39])=[O:40].[K+:27].[K+:28].[O-:29][C:30]([O-:31])=[O:32].[OH2:41].[S:1]([C:2]#[N:3])[c:4]1[cH:5][n:6][c:7]([NH2:9])[s:8]1.[SH:10][CH2:11][CH:12]([OH:13])[CH:14]([OH:15])[CH2:16][SH:17]>>[S:1]([c:4]1[cH:5][n:6][c:7]([NH2:9])[s:8]1)[C:22]([C:21]([O:20][CH2:18][CH3:19])=[O:26])([CH3:23])[CH3:24]

Participants

9

Reactant 8

HCID 813Potassium Cation2×HCID 887MethanolHCID 962WaterHCID 8857Ethyl AcetateHCID 11745Propanoic acid, 2-bromo-2-methyl-, ethyl esterHCID 190011,4-Dimercapto-2,3-butanediolHCID 19660Carbonate IonHCID 3109677[(2-Amino-1,3-thiazol-5-yl)sulfanyl]formonitrile

Product 1

HCID 57481427Ethyl 2-[(2-amino-1,3-thiazol-5-yl)sulfanyl]-2-methylpropanoate

Sources & evidence

ORD record
ord-99c4c380de4249cabf3a1e4981dc2a35
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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