Chem
J-GLOBAL ID:200907078060979340   Nikkaji number:J1.952.512K

2-(4-Methoxybenzylthio)-2,3,5,10-tetrahydrospiro[benzo[g]quinoline-4(1H),1′-[2,5]cyclohexadiene]-4′,5,10-trione

2-(4-メトキシベンジルチオ)-2,3,5,10-テトラヒドロスピロ[ベンゾ[g]キノリン-4(1H),1′-[2,5]シクロヘキサジエン]-4′,5,10-トリオン
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: C26H21NO4S
Molecular formula furigana: C26-H21-N-O4-S
Molecular weight: 443.520
InChI: InChI=1S/C26H21NO4S/c1-31-18-8-6-16(7-9-18)15-32-21-14-26(12-10-17(28)11-13-26)22-23(27-21)25(30)20-5-3-2-4-19(20)24(22)29/h2-13,21,27H,14-15H2,1H3
InChI key: ZIZFVVPDVPZGAX-UHFFFAOYSA-N
SMILES: COc1ccc(CSC2CC3(C=CC(=O)C=C3)C3=C(N2)C(=O)c2ccccc2C3=O)cc1
Systematic name  (3):
  • 2-(4-メトキシベンジルチオ)-2,3,5,10-テトラヒドロスピロ[ベンゾ[g]キノリン-4(1H),1′-[2,5]シクロヘキサジエン]-4′,5,10-トリオン
  • 2-{[(4-メトキシフェニル)メチル]スルファニル}-2,3,5,10-テトラヒドロ-1H-スピロ[ベンゾ[g]キノリン-4,1'-シクロヘキサン]-2',5'-ジエン-4',5,10-トリオン
  • 2-{[(4-methoxyphenyl)methyl]sulfanyl}-2,3,5,10-tetrahydro-1H-spiro[benzo[g]quinoline-4,1'-cyclohexane]-2',5'-diene-4',5,10-trione
Other name (1):
  • 2-(4-Methoxybenzylthio)-2,3,5,10-tetrahydrospiro[benzo[g]quinoline-4(1H),1′-[2,5]cyclohexadiene]-4′,5,10-trione
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