Chem
J-GLOBAL ID:200907026231409989   Nikkaji number:J1.161.204K

(2S)-2-(Phenylsulfonylamino)-3-[[5-[2-(4-piperidinyl)ethyl]thieno[3,2-b]thiophen-2-yl]carbonylamino]propanoic acid

(2S)-2-ベンゼンスルホンアミド-3-({5-[2-(ピペリジン-4-イル)エチル]チエノ[3,2-b]チオフェン-2-イル}ホルムアミド)プロパン酸
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: C23H27N3O5S3
Molecular formula furigana: C23-H27-N3-O5-S3
Molecular weight: 521.669
InChI: InChI=1S/C23H27N3O5S3/c27-22(25-14-18(23(28)29)26-34(30,31)17-4-2-1-3-5-17)21-13-20-19(33-21)12-16(32-20)7-6-15-8-10-24-11-9-15/h1-5,12-13,15,18,24,26H,6-11,14H2,(H,25,27)(H,28,29)/t18-/m0/s1
InChI key: NUWUKVFQPXUSBR-SFHVURJKSA-N
SMILES: OC(=O)[C@H](CNC(=O)c1cc2sc(CCC3CCNCC3)cc2s1)NS(=O)(=O)c1ccccc1
Systematic name  (3):
  • (2S)-2-(フェニルスルホニルアミノ)-3-[[5-[2-(4-ピペリジニル)エチル]チエノ[3,2-b]チオフェン-2-イル]カルボニルアミノ]プロパン酸
  • (2S)-2-ベンゼンスルホンアミド-3-({5-[2-(ピペリジン-4-イル)エチル]チエノ[3,2-b]チオフェン-2-イル}ホルムアミド)プロパン酸
  • (2S)-2-benzenesulfonamido-3-({5-[2-(piperidin-4-yl)ethyl]thieno[3,2-b]thiophen-2-yl}formamido)propanoic acid
Other name (1):
  • (2S)-2-(Phenylsulfonylamino)-3-[[5-[2-(4-piperidinyl)ethyl]thieno[3,2-b]thiophen-2-yl]carbonylamino]propanoic acid
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