Chem
J-GLOBAL ID：200907002795658729   Nikkaji number：J712.005B

SD-65b

(R)-2-(3,4-ジメトキシフェニル)-2-[(1S,3S)-3-(3,4-ジメトキシフェネチルアミノ)シクロヘキシル]-3-メチルブチロニトリル
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： C29H40N2O4
Molecular formula furigana： C29-H40-N2-O4
Molecular weight： 480.649
InChI： InChI=1S/C29H40N2O4/c1-20(2)29(19-30,23-11-13-26(33-4)28(18-23)35-6)22-8-7-9-24(17-22)31-15-14-21-10-12-25(32-3)27(16-21)34-5/h10-13,16,18,20,22,24,31H,7-9,14-15,17H2,1-6H3/t22-,24-,29-/m0/s1
InChI key： DUNPNGZZOYBONZ-AQGBOPFGSA-N
SMILES： COc1ccc(CCN[C@H]2CCC[C@@H](C2)[C@](C#N)(C(C)C)c2ccc(OC)c(OC)c2)cc1OC
Systematic name  (3)：
  • (R)-2-(3,4-ジメトキシフェニル)-2-[(1S,3S)-3-(3,4-ジメトキシフェネチルアミノ)シクロヘキシル]-3-メチルブチロニトリル
  • (2R)-2-(3,4-ジメトキシフェニル)-2-[(1S,3S)-3-{[2-(3,4-ジメトキシフェニル)エチル]アミノ}シクロヘキシル]-3-メチルブタンニトリル
  • (2R)-2-(3,4-dimethoxyphenyl)-2-[(1S,3S)-3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}cyclohexyl]-3-methylbutanenitrile
Other name (2)：
  • SD-65b
  • (R)-2-(3,4-Dimethoxyphenyl)-2-[(1S,3S)-3-(3,4-dimethoxyphenethylamino)cyclohexyl]-3-methylbutyronitrile
Thsaurus map：
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