Chem
J-GLOBAL ID：201607005455013485   Nikkaji number：J3.535.087J

ACT-335827

(αR,1S)-1-[(3,4-ジメトキシフェニル)メチル]-3,4-ジヒドロ-6,7-ジメトキシ-N-(1-メチルエチル)-α-フェニル-2(1H)-イソキノリンアセトアミド
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： C31H38N2O5
Molecular formula furigana： C31-H38-N2-O5
Molecular weight： 518.654
InChI： InChI=1S/C31H38N2O5/c1-20(2)32-31(34)30(22-10-8-7-9-11-22)33-15-14-23-18-28(37-5)29(38-6)19-24(23)25(33)16-21-12-13-26(35-3)27(17-21)36-4/h7-13,17-20,25,30H,14-16H2,1-6H3,(H,32,34)/t25-,30+/m0/s1
InChI key： HXHOBPVRRPCTLG-SETSBSEESA-N
SMILES： COc1ccc(C[C@@H]2N(CCc3cc(OC)c(OC)cc23)[C@@H](C(=O)NC(C)C)c2ccccc2)cc1OC
Systematic name  (4)：
  • (2R)-2-[(1S)-1-[(3,4-ジメトキシフェニル)メチル]-6,7-ジメトキシ-3,4-ジヒドロ-1H-イソキノリン-2-イル]-2-フェニル-N-プロパン-2-イルアセトアミド
  • (αR,1S)-1-[(3,4-ジメトキシフェニル)メチル]-3,4-ジヒドロ-6,7-ジメトキシ-N-(1-メチルエチル)-α-フェニル-2(1H)-イソキノリンアセトアミド
  • (2R)-2-[(1S)-1-[(3,4-ジメトキシフェニル)メチル]-6,7-ジメトキシ-1,2,3,4-テトラヒドロイソキノリン-2-イル]-2-フェニル-N-(プロパン-2-イル)アセトアミド
  • (2R)-2-[(1S)-1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-yl]-2-phenyl-N-(propan-2-yl)acetamide
Other name (3)：
  • (2R)-2-[(1S)-1-[(3,4-Dimethoxyphenyl)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-2-phenyl-N-propane-2-ylacetamide
  • ACT-335827
  • (αR,1S)-1-[(3,4-Dimethoxyphenyl)methyl]-3,4-dihydro-6,7-dimethoxy-N-(1-methylethyl)-α-phenyl-2(1H)-isoquinolineacetamide
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