Chem
J-GLOBAL ID：200907047960307123   Nikkaji number：J631.973D

C-545T

C-545T
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： C26H26N2O2S
Molecular formula furigana： C26-H26-N2-O2-S
Molecular weight： 430.570
InChI： InChI=1S/C26H26N2O2S/c1-25(2)9-11-28-12-10-26(3,4)20-21(28)17(25)14-15-13-16(24(29)30-22(15)20)23-27-18-7-5-6-8-19(18)31-23/h5-8,13-14H,9-12H2,1-4H3
InChI key： MSDMPJCOOXURQD-UHFFFAOYSA-N
SMILES： CC1(C)CCN2CCC(C)(C)c3c2c1cc1cc(c2nc4ccccc4s2)c(=O)oc31
Systematic name  (13)：
  • 1,1,7,7-テトラメチル-10-(ベンゾチアゾール-2-イル)-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-11-オン
  • 10-(ベンゾチアゾール-2-イル)-1,1,7,7-テトラメチル-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-11-オン
  • α-(ベンゾチアゾール-2-イル)-1,1,7,7-テトラメチル-8-ヒドロキシ-1,2,6,7-テトラヒドロ-3H,5H-ベンゾ[ij]キノリジン-9-アクリル酸ラクトン
  • 10-(2-ベンゾチアゾリル)-2,3,6,7-テトラヒドロ-1,1,7,7-テトラメチル-1H,5H,11H-[1]ベンゾピラノ[6,7,8-ij]キノリジン-11-オン
  • 2,3,6,7-テトラヒドロ-10-(ベンゾチアゾール-2-イル)-1,1,7,7-テトラメチル-1H,5H,11H-[1]ベンゾピラノ[6,7,8-ij]キノリジン-11-オン
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Other name (16)：
  • 10-(Benzothiazol-2-yl)-1,1,7,7-tetramethyl-2,3,6,7-tetrahydro-1H,5H,11H-[1]benzopyrano[6,7,8-ij]quinolizin-11-one
  • 1,1,7,7-Tetramethyl-10-(benzothiazol-2-yl)-2,3,6,7-tetrahydro-1H,5H,11H-[1]benzopyrano[6,7,8-ij]quinolizin-11-one
  • C-545T
  • α-(Benzothiazole-2-yl)-1,1,7,7-tetramethyl-8-hydroxy-1,2,6,7-tetrahydro-3H,5H-benzo[ij]quinolizine-9-acrylic acid lactone
  • 10-(2-Benzothiazolyl)-2,3,6,7-tetrahydro-1,1,7,7-tetramethyl-1H,5H,11H-[1]benzopyrano[6,7,8-ij]quinolizine-11-one
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