Chem
J-GLOBAL ID:200907066884631808   Nikkaji number:J1.321.797A

1-Amino-2-(phenylthio)-4-(4-methylanilino)-9,10-anthraquinone

1-アミノ-2-(フェニルチオ)-4-(4-メチルアニリノ)-9,10-アントラキノン
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: C27H20N2O2S
Molecular formula furigana: C27-H20-N2-O2-S
Molecular weight: 436.530
InChI: InChI=1S/C27H20N2O2S/c1-16-11-13-17(14-12-16)29-21-15-22(32-18-7-3-2-4-8-18)25(28)24-23(21)26(30)19-9-5-6-10-20(19)27(24)31/h2-15,29H,28H2,1H3
InChI key: MIUVSQHLFWBYNI-UHFFFAOYSA-N
SMILES: Cc1ccc(Nc2cc(Sc3ccccc3)c(N)c3C(=O)c4ccccc4C(=O)c23)cc1
Systematic name  (3):
  • 1-アミノ-2-(フェニルチオ)-4-(4-メチルアニリノ)-9,10-アントラキノン
  • 1-アミノ-4-[(4-メチルフェニル)アミノ]-2-(フェニルスルファニル)-9,10-ジヒドロアントラセン-9,10-ジオン
  • 1-amino-4-[(4-methylphenyl)amino]-2-(phenylsulfanyl)-9,10-dihydroanthracene-9,10-dione
Other name (1):
  • 1-Amino-2-(phenylthio)-4-(4-methylanilino)-9,10-anthraquinone
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