Chem
J-GLOBAL ID：201807011392237668   Nikkaji number：J3.721.611I

(4S)-4-(4-Nitrophenylsulfonyl)-N,N′-dibenzyl-N-acetyl-1,7-heptanediamine

(4S)-4-(4-ニトロフェニルスルホニル)-N,N′-ジベンジル-N-アセチル-1,7-ヘプタンジアミン
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： C29H35N2[N+]O4[O-]S
Molecular formula furigana： C29-H35-N3-O5-S
Molecular weight： 537.680
InChI： InChI=1S/C29H35N3O5S/c1-24(33)31(23-26-12-6-3-7-13-26)21-9-15-28(14-8-20-30-22-25-10-4-2-5-11-25)38(36,37)29-18-16-27(17-19-29)32(34)35/h2-7,10-13,16-19,28,30H,8-9,14-15,20-23H2,1H3/t28-/m0/s1
InChI key： BSDZPTNOYYLGAO-NDEPHWFRSA-N
SMILES： CC(=O)N(CCC[C@H](CCCNCc1ccccc1)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-])Cc1ccccc1
Systematic name  (3)：
  • (4S)-4-(4-ニトロフェニルスルホニル)-N,N′-ジベンジル-N-アセチル-1,7-ヘプタンジアミン
  • N-ベンジル-N-[(4S)-7-(ベンジルアミノ)-4-(4-ニトロベンゼンスルホニル)ヘプチル]アセトアミド
  • N-benzyl-N-[(4S)-7-(benzylamino)-4-(4-nitrobenzenesulfonyl)heptyl]acetamide
Other name (1)：
  • (4S)-4-(4-Nitrophenylsulfonyl)-N,N′-dibenzyl-N-acetyl-1,7-heptanediamine
Thsaurus map：
Thesaurus Map

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