Phosgene → 2-t-Butyl-1,3,4-thiadiazol-5-yl Isocyanate

HRID 2136947Notes

Reaction equation

HRID 2136947 reaction equation
[C:5]([CH3:6])([CH3:7])([CH3:8])[c:9]1[n:10][n:11][c:12]([NH2:14])[s:13]1.[CH3:15][CH2:16][O:17][C:18](=[O:19])[CH3:20].[Cl:1][C:2]([Cl:3])=[O:4]>>[C:2](=[O:4])=[N:14][c:12]1[n:11][n:10][c:9]([C:5]([CH3:6])([CH3:7])[CH3:8])[s:13]1

Participants

4

Reactant 3

HCID 6371PhosgeneHCID 8857Ethyl AcetateHCID 170170Buthidazolamine

Product 1

HCID 64524562-t-Butyl-1,3,4-thiadiazol-5-yl Isocyanate

Sources & evidence

ORD record
ord-cebb2ff64b204b0cbbcf68a3d44610f9
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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