Phosphate → 2-(Methyloxycarbonyl)amino-4-isopropyl-7-methyl-benzothiazole-6-thiol

HRID 1859536Notes

Reaction equation

HRID 1859536 reaction equation
[CH3:1][O:2][C:3]([NH:5][C:6]1[S:7][C:8]2[C:14]([CH3:15])=[C:13]([S:16]C#N)[CH:12]=[C:11]([CH:19]([CH3:21])[CH3:20])[C:9]=2[N:10]=1)=[O:4].SC[C@H]([C@@H](CS)O)O.P([O-])([O-])([O-])=O>CCO>[CH3:1][O:2][C:3]([NH:5][C:6]1[S:7][C:8]2[C:14]([CH3:15])=[C:13]([SH:16])[CH:12]=[C:11]([CH:19]([CH3:21])[CH3:20])[C:9]=2[N:10]=1)=[O:4]

Participants

5

Reactant 3

HCID 1061PhosphateHCID 446094D-1,4-DithiothreitolHCID 225730782-(Methyloxycarbonyl)amino-4-isopropyl-7-methyl-6-thiocyanato-benzothiazole

Product 1

HCID 225729772-(Methyloxycarbonyl)amino-4-isopropyl-7-methyl-benzothiazole-6-thiol

Reagents, catalysts & solvents 1

HCID 702EthanolSolvent

Procedure

The title compound was prepared according to General Method 14 using 2-(methyloxycarbonyl)amino-4-isopropyl-7-methyl-6-thiocyanato-benzothiazole (1.5 g, 4.7 mmol), dithiothreitol (2.9 g, 18.7 mmol), EtOH (50 mL), and phosphate buffer (15 mL). MS (APCI): 296 (M−H).

Sources & evidence

ORD record
ord-2c30a77d2f2c4e1397f30357085b1649
Source dataset
uspto-grants-2003_03
Patent number
US06528510B1

Reaction notes

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