Chem
J-GLOBAL ID：200907002762699730   Nikkaji number：J775.299G

N-[α-(Methoxycarbonyl)phenethyl]-N-[(Z)-2-methyl-3-(phenylthio)-1-propenyl]-3-oxobutyramide

N-[α-(メトキシカルボニル)フェネチル]-N-[(Z)-2-メチル-3-(フェニルチオ)-1-プロペニル]-3-オキソブチルアミド
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： C24H27NO4S
Molecular formula furigana： C24-H27-N-O4-S
Molecular weight： 425.540
InChI： InChI=1S/C24H27NO4S/c1-18(17-30-21-12-8-5-9-13-21)16-25(23(27)14-19(2)26)22(24(28)29-3)15-20-10-6-4-7-11-20/h4-13,16,22H,14-15,17H2,1-3H3/b18-16-
InChI key： RRSNPOOETYQUCZ-VLGSPTGOSA-N
SMILES： COC(=O)C(Cc1ccccc1)N(/C=C(/C)\CSc1ccccc1)C(=O)CC(=O)C
Systematic name  (3)：
  • N-[α-(メトキシカルボニル)フェネチル]-N-[(Z)-2-メチル-3-(フェニルチオ)-1-プロペニル]-3-オキソブチルアミド
  • メチル 2-{N-[(1Z)-2-メチル-3-(フェニルスルファニル)プロパ-1-エン-1-イル]-3-オキソブタンアミド}-3-フェニルプロパノアート
  • methyl 2-{N-[(1Z)-2-methyl-3-(phenylsulfanyl)prop-1-en-1-yl]-3-oxobutanamido}-3-phenylpropanoate
Other name (1)：
  • N-[α-(Methoxycarbonyl)phenethyl]-N-[(Z)-2-methyl-3-(phenylthio)-1-propenyl]-3-oxobutyramide
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