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Phosphate → 2-Amino-5-tert-butyl-benzothiazole-6-thiol

HRID 23459
Notes
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Reaction equation

HRID 23459 reaction equation
[C:1]([C:5]1[C:6]([S:15]C#N)=[CH:7][C:8]2[S:12][C:11]([NH2:13])=[N:10][C:9]=2[CH:14]=1)([CH3:4])([CH3:3])[CH3:2].SC[C@H]([C@@H](CS)O)O.P([O-])([O-])([O-])=O>CCO>[NH2:13][C:11]1[S:12][C:8]2[CH:7]=[C:6]([SH:15])[C:5]([C:1]([CH3:4])([CH3:3])[CH3:2])=[CH:14][C:9]=2[N:10]=1
ParticipantsProcedureSources & evidenceReaction notes

Participants

5

Reactant 3

HCID 1061PhosphateHCID 446094D-1,4-DithiothreitolHCID 154738385-Tert-butyl-6-thiocyanato-benzothiazol-2-yl-amine

Product 1

HCID 225728932-Amino-5-tert-butyl-benzothiazole-6-thiol

Reagents, catalysts & solvents 1

HCID 702EthanolSolvent

Procedure

The title compound was prepared according to General Method 14 using 5-tert-butyl-6-thiocyanato-benzothiazol-2-yl-amine (Example L-1; 8 g, 30 mmol), dithiothreitol (18.7 g, 121 mmol), EtOH (200 mL), and phosphate buffer (50 mL). MS (APCI): 239 (M+H).

Sources & evidence

ORD record
ord-cbb2200b505743f89d88f8471e6e0c7a
Source dataset
uspto-grants-2005_02
DOI
10.6084/m9.figshare.5104873.v1
Patent number
US06852711B2

Reaction notes

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On this pageParticipantsProcedureSources & evidenceReaction notes