Chem
J-GLOBAL ID：201707020547503590   Nikkaji number：J3.650.000J

2-(4-Methoxyphenyl)-3-(phenylthiomethyl)-4-(thymine-1-ylmethyl)furan

2-(4-メトキシフェニル)-3-(フェニルチオメチル)-4-(チミン-1-イルメチル)フラン
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： C24H22N2O4S
Molecular formula furigana： C24-H22-N2-O4-S
Molecular weight： 434.510
InChI： InChI=1S/C24H22N2O4S/c1-16-12-26(24(28)25-23(16)27)13-18-14-30-22(17-8-10-19(29-2)11-9-17)21(18)15-31-20-6-4-3-5-7-20/h3-12,14H,13,15H2,1-2H3,(H,25,27,28)
InChI key： FVZBEXDTBIISGX-UHFFFAOYSA-N
SMILES： COc1ccc(cc1)c1occ(Cn2cc(C)c(=O)[nH]c2=O)c1CSc1ccccc1
Systematic name  (3)：
  • 2-(4-メトキシフェニル)-3-(フェニルチオメチル)-4-(チミン-1-イルメチル)フラン
  • 1-{[5-(4-メトキシフェニル)-4-[(フェニルスルファニル)メチル]フラン-3-イル]メチル}-5-メチル-1,2,3,4-テトラヒドロピリミジン-2,4-ジオン
  • 1-{[5-(4-methoxyphenyl)-4-[(phenylsulfanyl)methyl]furan-3-yl]methyl}-5-methyl-1,2,3,4-tetrahydropyrimidine-2,4-dione
Other name (1)：
  • 2-(4-Methoxyphenyl)-3-(phenylthiomethyl)-4-(thymine-1-ylmethyl)furan
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