Chem
J-GLOBAL ID:200907033736854835   Nikkaji number:J1.678.419B

4-(2,4-Dichloro-5-methoxyanilino)-6-methoxy-7-(3-piperazinopropoxy)quinoline-3-carbonitrile

4-(2,4-ジクロロ-5-メトキシアニリノ)-6-メトキシ-7-(3-ピペラジノプロポキシ)キノリン-3-カルボニトリル
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: C25H27Cl2N5O3
Molecular formula furigana: C25-H27-CL2-N5-O3
Molecular weight: 516.419
InChI: InChI=1S/C25H27Cl2N5O3/c1-33-22-13-21(18(26)11-19(22)27)31-25-16(14-28)15-30-20-12-24(23(34-2)10-17(20)25)35-9-3-6-32-7-4-29-5-8-32/h10-13,15,29H,3-9H2,1-2H3,(H,30,31)
InChI key: WJNXCARNBUNEMQ-UHFFFAOYSA-N
SMILES: COc1cc(Nc2c(cnc3cc(OCCCN4CCNCC4)c(OC)cc23)C#N)c(Cl)cc1Cl
Systematic name  (3):
  • 4-(2,4-ジクロロ-5-メトキシアニリノ)-6-メトキシ-7-(3-ピペラジノプロポキシ)キノリン-3-カルボニトリル
  • 4-[(2,4-ジクロロ-5-メトキシフェニル)アミノ]-6-メトキシ-7-[3-(ピペラジン-1-イル)プロポキシ]キノリン-3-カルボニトリル
  • 4-[(2,4-dichloro-5-methoxyphenyl)amino]-6-methoxy-7-[3-(piperazin-1-yl)propoxy]quinoline-3-carbonitrile
Other name (1):
  • 4-(2,4-Dichloro-5-methoxyanilino)-6-methoxy-7-(3-piperazinopropoxy)quinoline-3-carbonitrile
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