Chem
J-GLOBAL ID：200907036891547409   Nikkaji number：J2.408.102H

Polycarpaurine C

ポリカルパウリンC
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： C11H12N3O3[O-]S2
Molecular formula furigana： C11-H12-N3-O4-S2
Molecular weight： 314.350
InChI： InChI=1S/C11H13N3O4S2/c1-14-10(19-20(15,16)17)9(13-11(14)12)7-3-5-8(18-2)6-4-7/h3-6H,1-2H3,(H2,12,13)(H,15,16,17)/p-1
InChI key： CCJRKLGKLWSYTN-UHFFFAOYSA-M
SMILES： COc1ccc(cc1)c1nc(N)n(C)c1SS(=O)(=O)[O-]
Systematic name  (3)：
  • 1-メチル-2-アミノ-4-(4-メトキシフェニル)-5-(スルホナトチオ)-1H-イミダゾール
  • [2-アミノ-4-(4-メトキシフェニル)-1-メチル-1H-イミダゾール-5-イル]スルファンスルホナート
  • [2-amino-4-(4-methoxyphenyl)-1-methyl-1H-imidazol-5-yl]sulfanesulfonate
Other name (3)：
  • 1-Methyl-2-amino-4-(4-methoxyphenyl)-5-(sulfonatothio)-1H-imidazole
  • ポリカルパウリンC
  • Polycarpaurine C
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