Chem
J-GLOBAL ID:200907094839109711   Nikkaji number:J1.964.005A

[1-[6-[[(9S)-6′-Methoxy-10,11-dihydrocinchonan-9-yl]oxy]pyridazine-3-yl]pyrrolidine-2β-yl](indoline-1-yl) ketone

[1-[6-[[(9S)-6′-メトキシ-10,11-ジヒドロシンコナン-9-イル]オキシ]ピリダジン-3-イル]ピロリジン-2β-イル](インドリン-1-イル)ケトン
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: C37H42N6O3
Molecular formula furigana: C37-H42-N6-O3
Molecular weight: 618.782
InChI: InChI=1S/C37H42N6O3/c1-3-24-23-41-19-15-26(24)21-33(41)36(28-14-17-38-30-11-10-27(45-2)22-29(28)30)46-35-13-12-34(39-40-35)42-18-6-9-32(42)37(44)43-20-16-25-7-4-5-8-31(25)43/h4-5,7-8,10-14,17,22,24,26,32-33,36H,3,6,9,15-16,18-21,23H2,1-2H3/t24-,26-,32+,33+,36-/m0/s1
InChI key: UOKUJPHYIXVXIE-JWROXNTCSA-N
SMILES: CC[C@H]1CN2CC[C@H]1C[C@@H]2[C@@H](Oc1ccc(nn1)N1CCC[C@@H]1C(=O)N1CCc2ccccc12)c1ccnc2ccc(OC)cc12
Systematic name  (4):
  • [1-[6-[[(9S)-6′-メトキシ-10,11-ジヒドロシンコナン-9-イル]オキシ]ピリダジン-3-イル]ピロリジン-2β-イル](インドリン-1-イル)ケトン
  • 3-[[(9S)-6′-メトキシ-10,11-ジヒドロシンコナン-9-イル]オキシ]-6-[(2R)-2β-(2,3-ジヒドロ-1H-インドール-1-イルカルボニル)ピロリジノ]ピリダジン
  • 4-[(S)-({6-[(2R)-2-(2,3-ジヒドロ-1H-インドール-1-カルボニル)ピロリジン-1-イル]ピリダジン-3-イル}オキシ)[(2R,4S,5R)-5-エチル-1-アザビシクロ[2.2.2]オクタン-2-イル]メチル]-6-メトキシキノリン
  • 4-[(S)-({6-[(2R)-2-(2,3-dihydro-1H-indole-1-carbonyl)pyrrolidin-1-yl]pyridazin-3-yl}oxy)[(2R,4S,5R)-5-ethyl-1-azabicyclo[2.2.2]octan-2-yl]methyl]-6-methoxyquinoline
Other name (2):
  • [1-[6-[[(9S)-6′-Methoxy-10,11-dihydrocinchonan-9-yl]oxy]pyridazine-3-yl]pyrrolidine-2β-yl](indoline-1-yl) ketone
  • 3-[[(9S)-6′-Methoxy-10,11-dihydrocinchonan-9-yl]oxy]-6-[(2R)-2β-(2,3-dihydro-1H-indole-1-ylcarbonyl)pyrrolizino]pyridazine
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