Acetone → BM 11

HRID 2331091Notes

Reaction equation

HRID 2331091 reaction equation
[CH3:31][C:32]([CH3:33])=[O:34].[CH:21]1([N:27]=[C:28]=[S:29])[CH2:22][CH2:23][CH2:24][CH2:25][CH2:26]1.[CH:3]1([NH:10][c:11]2[c:12]([S:17](=[O:18])(=[O:19])[NH2:20])[cH:13][n:14][cH:15][cH:16]2)[CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9]1.[Na+:2].[OH-:1].[OH2:30].[OH2:35]>>[CH:3]1([NH:10][c:11]2[c:12]([S:17](=[O:18])(=[O:19])[NH:20][C:28]([NH:27][CH:21]3[CH2:22][CH2:23][CH2:24][CH2:25][CH2:26]3)=[S:29])[cH:13][n:14][cH:15][cH:16]2)[CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9]1

Participants

7

Reactant 6

HCID 180AcetoneHCID 923Sodium ionHCID 961HydroxideHCID 962Water2×HCID 14289Cyclohexyl isothiocyanateHCID 15135616HCID 15135616, compound

Product 1

HCID 3036083BM 11

Sources & evidence

ORD record
ord-f160f7fa256c441284c8103a52397555
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

Loading…