Chem
J-GLOBAL ID：200907074074993285   Nikkaji number：J2.012.307I

N-[(9R)-Cinchonan-9-yl]-4-methylbenzenesulfonamide

N-[(9R)-シンコナン-9-イル]-4-メチルベンゼンスルホンアミド
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： C26H29N3O2S
Molecular formula furigana： C26-H29-N3-O2-S
Molecular weight： 447.600
InChI： InChI=1S/C26H29N3O2S/c1-3-19-17-29-15-13-20(19)16-25(29)26(23-12-14-27-24-7-5-4-6-22(23)24)28-32(30,31)21-10-8-18(2)9-11-21/h3-12,14,19-20,25-26,28H,1,13,15-17H2,2H3/t19-,20-,25+,26+/m0/s1
InChI key： QWGLARSAVFCFAV-JZKJUIAGSA-N
SMILES： Cc1ccc(cc1)S(=O)(=O)N[C@@H]([C@H]1C[C@@H]2CCN1C[C@@H]2C=C)c1ccnc2ccccc12
Systematic name  (3)：
  • N-[(9R)-シンコナン-9-イル]-4-メチルベンゼンスルホンアミド
  • N-[(R)-[(2R,4S,5R)-5-エテニル-1-アザビシクロ[2.2.2]オクタン-2-イル](キノリン-4-イル)メチル]-4-メチルベンゼン-1-スルホンアミド
  • N-[(R)-[(2R,4S,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl](quinolin-4-yl)methyl]-4-methylbenzene-1-sulfonamide
Other name (1)：
  • N-[(9R)-Cinchonan-9-yl]-4-methylbenzenesulfonamide
Thsaurus map：
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