n-Heptyl isocyanate → 5-Chloro-2-oxobenzothiazole 3-heptylcarboxamide

HRID 1677652Notes

Reaction equation

HRID 1677652 reaction equation
[Cl:1][C:2]1[CH:3]=[CH:4][C:5]2[S:9][C:8](=[O:10])[NH:7][C:6]=2[CH:11]=1.N([CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][CH3:21])=C=O>O1CCOCC1>[Cl:1][C:2]1[CH:3]=[CH:4][C:5]2[S:9][C:8](=[O:10])[NH:7][C:6]=2[CH:11]=1.[CH3:21][CH2:20][CH:19]([C:8]([NH2:7])=[O:10])[CH2:18][CH2:17][CH2:16][CH3:15]

Participants

4

Reactant 2

HCID 138341n-Heptyl isocyanateHCID 6038292(3H)-Benzothiazolone, 5-chloro-

Product 1

HCID 1317291255-Chloro-2-oxobenzothiazole 3-heptylcarboxamide

Reagents, catalysts & solvents 1

HCID 312751,4-DioxaneSolvent

Procedure

300 mg (1.37 mmol) of 5-chloro-3H-benzothiazol-2-one were reacted in analogy to Example 1 with 174 mg (1.37 mmol) of 1-isocyanatoheptane in dioxane at 80° C. Yield: 100 mg (19%), M+H+: 327.38.

Sources & evidence

ORD record
ord-5274f2d4d4ba48fa86883c05a0364f45
Source dataset
uspto-grants-2011_08
Patent number
US08008331B2

Reaction notes

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