Benzoyl isothiocyanate → HCID 86625232, compound

HRID 44343Notes

Reaction equation

HRID 44343 reaction equation
[NH2:1][C:2]1[S:3][C:4]([CH2:10][OH:11])=[C:5]([CH3:9])[C:6]=1[C:7]#[N:8].[C:12]([N:20]=[C:21]=[S:22])(=[O:19])[C:13]1[CH:18]=[CH:17][CH:16]=[CH:15][CH:14]=1>>[C:7]([C:6]1[C:5]([CH3:9])=[C:4]([CH2:10][OH:11])[S:3][C:2]=1[NH:1][C:21]([NH:20][C:12](=[O:19])[C:13]1[CH:14]=[CH:15][CH:16]=[CH:17][CH:18]=1)=[S:22])#[N:8]

Participants

3

Reactant 2

HCID 68284Benzoyl isothiocyanateHCID 57456907HCID 57456907, compound

Product 1

HCID 86625232HCID 86625232, compound

Procedure

Prepared as in example 1a from 2-amino-5-(hydroxymethyl)-4-methylthiophene-3-carbonitrile (Example 9b) and benzoyl isothiocyanate as a yellow solid. MS 332 (MH+).

Sources & evidence

ORD record
ord-238b5ca57e524e038c88b39c4bc89991
Source dataset
uspto-grants-2013_09
Patent number
US08541421B2

Reaction notes

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