Chem
J-GLOBAL ID：200907079829438173   Nikkaji number：J556.890K

MKC-442

MKC-442
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： C17H22N2O3
Molecular formula furigana： C17-H22-N2-O3
Molecular weight： 302.374
InChI： InChI=1S/C17H22N2O3/c1-4-22-11-19-14(10-13-8-6-5-7-9-13)15(12(2)3)16(20)18-17(19)21/h5-9,12H,4,10-11H2,1-3H3,(H,18,20,21)
InChI key： MLILORUFDVLTSP-UHFFFAOYSA-N
SMILES： CCOCn1c(Cc2ccccc2)c(C(C)C)c(=O)[nH]c1=O
Systematic name  (6)：
  • 1-(エトキシメチル)-5-イソプロピル-6-ベンジルピリミジン-2,4(1H,3H)-ジオン
  • 5-イソプロピル-1-[エトキシメチル]-6-ベンジルピリミジン-2,4(1H,3H)-ジオン
  • 6-ベンジル-1-(エトキシメチル)-5-(1-メチルエチル)ウラシル
  • 1-エトキシメチル-5-イソプロピル-6-ベンジルウラシル
  • 6-ベンジル-1-(エトキシメチル)-5-(プロパン-2-イル)-1,2,3,4-テトラヒドロピリミジン-2,4-ジオン
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Other name (8)：
  • MKC-442
  • 1-Ethoxymethyl-5-isopropyl-6-benzyluracil
  • 6-Benzyl-1-(ethoxymethyl)-5-(1-methylethyl)uracil
  • エミビリン
  • Emivirine
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CAS registry number： 149950-60-7
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