Chem
J-GLOBAL ID：200907012166629878   Nikkaji number：J1.758.886I

N-[(1S,2R)-1-Propyl-2-[[(1S,4R)-4,7,7-trimethyl-3-oxobicyclo[2.2.1]heptane-2α-yl]seleno]pentyl]thiobenzamide

N-[(1S,2R)-1-プロピル-2-[[(1S,4R)-4,7,7-トリメチル-3-オキソビシクロ[2.2.1]ヘプタン-2α-イル]セレノ]ペンチル]チオベンズアミド
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： C25H37NOSSe
Molecular formula furigana： C25-H37-N-O-S-SE
Molecular weight： 478.610
InChI： InChI=1S/C25H37NOSSe/c1-6-11-19(26-23(28)17-13-9-8-10-14-17)20(12-7-2)29-21-18-15-16-25(5,22(21)27)24(18,3)4/h8-10,13-14,18-21H,6-7,11-12,15-16H2,1-5H3,(H,26,28)/t18-,19+,20-,21+,25+/m1/s1
InChI key： ZVPMSGMRVHVJBH-GBHCNSOCSA-N
SMILES： CCC[C@H](NC(=S)c1ccccc1)[C@@H](CCC)[Se][C@H]1[C@H]2CC[C@@](C)(C1=O)C2(C)C
Systematic name  (3)：
  • N-[(1S,2R)-1-プロピル-2-[[(1S,4R)-4,7,7-トリメチル-3-オキソビシクロ[2.2.1]ヘプタン-2α-イル]セレノ]ペンチル]チオベンズアミド
  • N-[(4S,5R)-5-{[(1S,2S,4R)-4,7,7-トリメチル-3-オキソビシクロ[2.2.1]ヘプタン-2-イル]セラニル}オクタン-4-イル]ベンゼンカルボチオアミド
  • N-[(4S,5R)-5-{[(1S,2S,4R)-4,7,7-trimethyl-3-oxobicyclo[2.2.1]heptan-2-yl]selanyl}octan-4-yl]benzenecarbothioamide
Other name (1)：
  • N-[(1S,2R)-1-Propyl-2-[[(1S,4R)-4,7,7-trimethyl-3-oxobicyclo[2.2.1]heptane-2α-yl]seleno]pentyl]thiobenzamide
Thsaurus map：
Thesaurus Map

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