Ethanol → HCID 53716090, compound

HRID 289221Notes

Reaction equation

HRID 289221 reaction equation
[C:18]([CH3:19])([CH3:20])([CH3:21])[N:22]=[C:23]=[S:24].[C:1]([CH3:2])(=[O:3])[NH:4][CH:5]([C:6](=[O:7])[OH:8])[c:9]1[cH:10][cH:11][c:12]([NH2:15])[cH:13][cH:14]1.[CH3:26][CH2:27][OH:28].[Na+:17].[OH-:16].[OH2:25]>>[C:1]([CH3:2])(=[O:3])[NH:4][CH:5]([C:6](=[O:7])[OH:8])[c:9]1[cH:10][cH:11][c:12]([NH:15][C:23]([NH:22][C:18]([CH3:19])([CH3:20])[CH3:21])=[S:24])[cH:13][cH:14]1

Participants

7

Reactant 6

HCID 702EthanolHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 11544tert-Butyl isothiocyanateHCID 14037275HCID 14037275, compound

Product 1

HCID 53716090HCID 53716090, compound

Sources & evidence

ORD record
ord-c20b4e826c2d43e881832feccd8cd6c7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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