Acetone → HCID 20371120, compound

HRID 2148951Notes

Reaction equation

HRID 2148951 reaction equation
[C:1]([CH3:2])(=[O:3])[NH:4][c:5]1[c:6]([NH2:16])[cH:7][c:8]([S:11](=[O:12])[CH2:13][C:14]#[CH:15])[cH:9][cH:10]1.[CH3:17][O:18][C:19](=[O:20])[N:21]=[C:22]=[S:23].[CH3:24][C:25](=[O:26])[CH3:27]>>[C:1]([CH3:2])(=[O:3])[NH:4][c:5]1[c:6]([NH:16][C:22]([NH:21][C:19]([O:18][CH3:17])=[O:20])=[S:23])[cH:7][c:8]([S:11](=[O:12])[CH2:13][C:14]#[CH:15])[cH:9][cH:10]1

Participants

4

Reactant 3

HCID 180AcetoneHCID 552246Methoxycarbonyl isothiocyanateHCID 20371170HCID 20371170, compound

Product 1

HCID 20371120HCID 20371120, compound

Sources & evidence

ORD record
ord-a47eb3936b7d48eba9d0c2ff1a632c4b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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