Chem
J-GLOBAL ID：200907050563040790   Nikkaji number：J1.321.803J

3-(Phenylthio)-5-(4-methylanilino)-6H-anthra[1,9-cd]isoxazole-6-one

3-(フェニルチオ)-5-(4-メチルアニリノ)-6H-アントラ[1,9-cd]イソオキサゾール-6-オン
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： C27H18N2O2S
Molecular formula furigana： C27-H18-N2-O2-S
Molecular weight： 434.510
InChI： InChI=1S/C27H18N2O2S/c1-16-11-13-17(14-12-16)28-21-15-22(32-18-7-3-2-4-8-18)25-24-23(21)26(30)19-9-5-6-10-20(19)27(24)31-29-25/h2-15,28H,1H3
InChI key： FZBLFZJLKUWTQE-UHFFFAOYSA-N
SMILES： Cc1ccc(Nc2cc(Sc3ccccc3)c3noc4c5ccccc5C(=O)c2c34)cc1
Systematic name  (3)：
  • 3-(フェニルチオ)-5-(4-メチルアニリノ)-6H-アントラ[1,9-cd]イソオキサゾール-6-オン
  • 10-[(4-メチルフェニル)アミノ]-12-(フェニルスルファニル)-15-オキサ-14-アザテトラシクロ[7.6.1.02,7.013,16]ヘキサデカ-1(16),2,4,6,9,11,13-ヘプタエン-8-オン
  • 10-[(4-methylphenyl)amino]-12-(phenylsulfanyl)-15-oxa-14-azatetracyclo[7.6.1.02,7.013,16]hexadeca-1(16),2,4,6,9,11,13-heptaen-8-one
Other name (1)：
  • 3-(Phenylthio)-5-(4-methylanilino)-6H-anthra[1,9-cd]isoxazole-6-one
Thsaurus map：
Thesaurus Map

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