Chem
J-GLOBAL ID:200907008953260116   Nikkaji number:J889.375F

1-Phenyl-2-mercapto-5,6-dimethyl-7-thia-1,3,3a,8-tetraaza-s-indacen-4(1H)-one

1-フェニル-2-メルカプト-5,6-ジメチル-7-チア-1,3,3a,8-テトラアザ-s-インダセン-4(1H)-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: C15H12N4OS2
Molecular formula furigana: C15-H12-N4-O-S2
Molecular weight: 328.410
InChI: InChI=1S/C15H12N4OS2/c1-8-9(2)22-12-11(8)13(20)19-14(16-12)18(15(21)17-19)10-6-4-3-5-7-10/h3-7H,1-2H3,(H,17,21)
InChI key: LPRZGSZJTPYSQV-UHFFFAOYSA-N
SMILES: Cc1sc2nc3n(c(S)nn3c(=O)c2c1C)c1ccccc1
Systematic name  (3):
  • 1-フェニル-2-メルカプト-5,6-ジメチル-7-チア-1,3,3a,8-テトラアザ-s-インダセン-4(1H)-オン
  • 4,5-ジメチル-10-フェニル-11-スルファニル-6-チア-1,8,10,12-テトラアザトリシクロ[7.3.0.03,7]ドデカ-3(7),4,8,11-テトラエン-2-オン
  • 4,5-dimethyl-10-phenyl-11-sulfanyl-6-thia-1,8,10,12-tetraazatricyclo[7.3.0.03,7]dodeca-3(7),4,8,11-tetraen-2-one
Other name (1):
  • 1-Phenyl-2-mercapto-5,6-dimethyl-7-thia-1,3,3a,8-tetraaza-s-indacen-4(1H)-one
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