Chem
J-GLOBAL ID:200907034606931591   Nikkaji number:J1.799.577D

1-(3,5-Dichlorophenylsulfonyl)-L-Pro-[(3S)-3-(4-biphenylyl)-βAla-]OH

1-(3,5-ジクロロフェニルスルホニル)-L-Pro-[(3S)-3-(4-ビフェニリル)-βAla-]OH
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: C26H24Cl2N2O5S
Molecular formula furigana: C26-H24-CL2-N2-O5-S
Molecular weight: 547.450
InChI: InChI=1S/C26H24Cl2N2O5S/c27-20-13-21(28)15-22(14-20)36(34,35)30-12-4-7-24(30)26(33)29-23(16-25(31)32)19-10-8-18(9-11-19)17-5-2-1-3-6-17/h1-3,5-6,8-11,13-15,23-24H,4,7,12,16H2,(H,29,33)(H,31,32)/t23-,24-/m0/s1
InChI key: KOZDYEZZZJTMAM-ZEQRLZLVSA-N
SMILES: OC(=O)C[C@H](NC(=O)[C@@H]1CCCN1S(=O)(=O)c1cc(Cl)cc(Cl)c1)c1ccc(cc1)c1ccccc1
Systematic name  (3):
  • 1-(3,5-ジクロロフェニルスルホニル)-L-Pro-[(3S)-3-(4-ビフェニリル)-βAla-]OH
  • (3S)-3-{[1,1'-ビフェニル]-4-イル}-3-{[(2S)-1-(3,5-ジクロロベンゼンスルホニル)ピロリジン-2-イル]ホルムアミド}プロパン酸
  • (3S)-3-{[1,1'-biphenyl]-4-yl}-3-{[(2S)-1-(3,5-dichlorobenzenesulfonyl)pyrrolidin-2-yl]formamido}propanoic acid
Other name (1):
  • 1-(3,5-Dichlorophenylsulfonyl)-L-Pro-[(3S)-3-(4-biphenylyl)-βAla-]OH
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