Chem
J-GLOBAL ID：200907088122966970   Nikkaji number：J732.117A

1-(2-Deoxy-4-thio-β-D-erythro-pentofuranosyl)-5-(1-fluoro-2,2-dichloroethenyl)uracil

1-(2-デオキシ-4-チオ-β-D-erythro-ペントフラノシル)-5-(1-フルオロ-2,2-ジクロロエテニル)ウラシル
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： C11H11Cl2FN2O4S
Molecular formula furigana： C11-H11-CL2-F-N2-O4-S
Molecular weight： 357.180
InChI： InChI=1S/C11H11Cl2FN2O4S/c12-9(13)8(14)4-2-16(11(20)15-10(4)19)7-1-5(18)6(3-17)21-7/h2,5-7,17-18H,1,3H2,(H,15,19,20)/t5-,6+,7+/m0/s1
InChI key： MHRRXVDFIDEAGA-RRKCRQDMSA-N
SMILES： OC[C@H]1S[C@H](C[C@@H]1O)n1cc(C(=C(Cl)Cl)F)c(=O)[nH]c1=O
Systematic name  (3)：
  • 1-(2-デオキシ-4-チオ-β-D-erythro-ペントフラノシル)-5-(1-フルオロ-2,2-ジクロロエテニル)ウラシル
  • 5-(2,2-ジクロロ-1-フルオロエテニル)-1-[(2R,4S,5R)-4-ヒドロキシ-5-(ヒドロキシメチル)チオラン-2-イル]-1,2,3,4-テトラヒドロピリミジン-2,4-ジオン
  • 5-(2,2-dichloro-1-fluoroethenyl)-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)thiolan-2-yl]-1,2,3,4-tetrahydropyrimidine-2,4-dione
Other name (1)：
  • 1-(2-Deoxy-4-thio-β-D-erythro-pentofuranosyl)-5-(1-fluoro-2,2-dichloroethenyl)uracil
Thsaurus map：
Thesaurus Map

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