Chem
J-GLOBAL ID:200907050253304003   Nikkaji number:J978.198F

2-[(6-Methylbenzothiazole-2-yl)azo]-5-[methyl(sulfomethyl)amino]benzoic acid

2-[(6-メチルベンゾチアゾール-2-イル)アゾ]-5-[メチル(スルホメチル)アミノ]安息香酸
Substance type:
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula: C17H16N4O5S2
Molecular formula furigana: C17-H16-N4-O5-S2
Molecular weight: 420.460
InChI: InChI=1S/C17H16N4O5S2/c1-10-3-5-14-15(7-10)27-17(18-14)20-19-13-6-4-11(8-12(13)16(22)23)21(2)9-28(24,25)26/h3-8H,9H2,1-2H3,(H,22,23)(H,24,25,26)
InChI key: TXNNOXBDBANPLQ-UHFFFAOYSA-N
SMILES: CN(CS(=O)(=O)O)c1ccc(N=Nc2nc3ccc(C)cc3s2)c(c1)C(=O)O
Systematic name  (3):
  • 2-[(6-メチルベンゾチアゾール-2-イル)アゾ]-5-[メチル(スルホメチル)アミノ]安息香酸
  • 5-[メチル(スルホメチル)アミノ]-2-[2-(6-メチル-1,3-ベンゾチアゾール-2-イル)ジアゼン-1-イル]安息香酸
  • 5-[methyl(sulfomethyl)amino]-2-[2-(6-methyl-1,3-benzothiazol-2-yl)diazen-1-yl]benzoic acid
Other name (1):
  • 2-[(6-Methylbenzothiazole-2-yl)azo]-5-[methyl(sulfomethyl)amino]benzoic acid
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