Chem
J-GLOBAL ID:200907018178801615   Nikkaji number:J2.551.178F

N-Methyl-N-phenyl-3-[[N-(benzyloxycarbonyl)-L-valyl]amino]tetrahydrothiophene-3β-carboxamide

N-メチル-N-フェニル-3-[[N-(ベンジルオキシカルボニル)-L-バリル]アミノ]テトラヒドロチオフェン-3β-カルボアミド
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: C25H31N3O4S
Molecular formula furigana: C25-H31-N3-O4-S
Molecular weight: 469.600
InChI: InChI=1S/C25H31N3O4S/c1-18(2)21(26-24(31)32-16-19-10-6-4-7-11-19)22(29)27-25(14-15-33-17-25)23(30)28(3)20-12-8-5-9-13-20/h4-13,18,21H,14-17H2,1-3H3,(H,26,31)(H,27,29)/t21-,25+/m0/s1
InChI key: VTZICGLWSRERPO-SQJMNOBHSA-N
SMILES: CC(C)[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@]1(CCSC1)C(=O)N(C)c1ccccc1
Systematic name  (3):
  • N-メチル-N-フェニル-3-[[N-(ベンジルオキシカルボニル)-L-バリル]アミノ]テトラヒドロチオフェン-3β-カルボアミド
  • ベンジル N-[(1S)-2-メチル-1-{[(3S)-3-[メチル(フェニル)カルバモイル]チオラン-3-イル]カルバモイル}プロピル]カルバマート
  • benzyl N-[(1S)-2-methyl-1-{[(3S)-3-[methyl(phenyl)carbamoyl]thiolan-3-yl]carbamoyl}propyl]carbamate
Other name (1):
  • N-Methyl-N-phenyl-3-[[N-(benzyloxycarbonyl)-L-valyl]amino]tetrahydrothiophene-3β-carboxamide
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