Chem
J-GLOBAL ID：200907032872040560   Nikkaji number：J1.887.294C

NKX-2677

NKX-2677
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： C31H28N2O4S2
Molecular formula furigana： C31-H28-N2-O4-S2
Molecular weight： 556.700
InChI： InChI=1S/C31H28N2O4S2/c1-30(2)9-11-33-12-10-31(3,4)25-26(33)21(30)15-17-14-20(29(36)37-27(17)25)22-7-8-24(39-22)23-6-5-19(38-23)13-18(16-32)28(34)35/h5-8,13-15H,9-12H2,1-4H3,(H,34,35)
InChI key： ZAFJUCKHIVBFIV-UHFFFAOYSA-N
SMILES： CC1(C)CCN2CCC(C)(C)c3c2c1cc1cc(c2ccc(s2)c2ccc(C=C(C#N)C(=O)O)s2)c(=O)oc31
Systematic name  (9)：
  • 2-シアノ-3-[5′-(2,3,6,7-テトラヒドロ-1,1,7,7-テトラメチル-11-オキソ-1H,5H,11H-[1]ベンゾピラノ[6,7,8-ij]キノリジン10-イル)-2,2′-ビチオフェン-5-イル]プロペン酸
  • 3-[5-[5-[(1,1,7,7-テトラメチル-11-オキソ-2,3,6,7-テトラヒドロ-1H,5H,11H-[1]ベンゾピラノ[6,7,8-ij]キノリジン)-10-イル]-2-チエニル]-2-チエニル]-2-シアノプロペン酸
  • 3-[5′-(2,3,6,7-テトラヒドロ-1,1,7,7-テトラメチル-11-オキソ-1H,5H,11H-[1]ベンゾピラノ[6,7,8-ij]キノリジン-10-イル)-5,2′-ビチオフェン-2-イル]-2-シアノプロペン酸
  • 2-シアノ-3-[5′-(2,3,6,7-テトラヒドロ-1,1,7,7-テトラメチル-11-オキソ-1H,5H,11H-[1]ベンゾピラノ[6,7,8-ij]キノリジン-10-イル)-5,2′-ビチオフェン-2-イル]プロペン酸
  • 2-シアノ-3-[5′-(1,1,6,6-テトラメチル-2,3,5,6-テトラヒドロ-10-オキソ-4H,10H-3a-アザ-11-オキサ-1H-ベンゾ[de]アントラセン-9-イル)-2,2′-ビチオフェン-5-イル]アクリル酸
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Other name (9)：
  • 2-Cyano-3-[5′-(2,3,6,7-tetrahydro-1,1,7,7-tetramethyl-11-oxo-1H,5H,11H-[1]benzopyrano[6,7,8-ij]quinolizine 10-yl)-2,2′-bithiophene-5-yl]propenoic acid
  • 3-[5-[5-[(1,1,7,7-Tetramethyl-11-oxo-2,3,6,7-tetrahydro-1H,5H,11H-[1]benzopyrano[6,7,8-ij]quinolizine)-10-yl]-2-thienyl]-2-thienyl]-2-cyanopropenoic acid
  • NKX-2677
  • 3-[5′-(2,3,6,7-Tetrahydro-1,1,7,7-tetramethyl-11-oxo-1H,5H,11H-[1]benzopyrano[6,7,8-ij]quinolizine-10-yl)-5,2′-bithiophene-2-yl]-2-cyanopropenoic acid
  • 2-Cyano-3-[5′-(2,3,6,7-tetrahydro-1,1,7,7-tetramethyl-11-oxo-1H,5H,11H-[1]benzopyrano[6,7,8-ij]quinolizine-10-yl)-5,2′-bithiophene-2-yl]propenoic acid
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