Chem
J-GLOBAL ID：200907039545233928   Nikkaji number：J1.012.204J

MRS-1505

2-(3-クロロフェニル)-4,6-ジエチル-5-[(プロピルチオ)カルボニル]-3-ピリジンカルボン酸プロピル
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： C23H28ClNO3S
Molecular formula furigana： C23-H28-CL-N-O3-S
Molecular weight： 433.990
InChI： InChI=1S/C23H28ClNO3S/c1-5-12-28-22(26)20-17(7-3)19(23(27)29-13-6-2)18(8-4)25-21(20)15-10-9-11-16(24)14-15/h9-11,14H,5-8,12-13H2,1-4H3
InChI key： RPTCJTNYKDJGHU-UHFFFAOYSA-N
SMILES： CCCOC(=O)c1c(CC)c(C(=O)SCCC)c(CC)nc1c1cccc(Cl)c1
Systematic name  (3)：
  • 2-(3-クロロフェニル)-4,6-ジエチル-5-[(プロピルチオ)カルボニル]-3-ピリジンカルボン酸プロピル
  • プロピル 2-(3-クロロフェニル)-4,6-ジエチル-5-[(プロピルスルファニル)カルボニル]ピリジン-3-カルボキシラート
  • propyl 2-(3-chlorophenyl)-4,6-diethyl-5-[(propylsulfanyl)carbonyl]pyridine-3-carboxylate
Other name (2)：
  • 2-(3-Chlorophenyl)-4,6-diethyl-5-[(propylthio)carbonyl]-3-pyridinecarboxylic acid propyl ester
  • MRS-1505
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