Chem
J-GLOBAL ID:200907042619942544
Nikkaji number:J569.872C
5-[(3,5-Difluorophenyl)ethynyl]-2′-deoxyuridine
5-[(3,5-ジフルオロフェニル)エチニル]-2′-デオキシウリジン
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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:
C17 H14 F2 N2 O5
Molecular formula furigana:
C17-H14-F2-N2-O5
Molecular weight:
364.305
InChI:
InChI=1S/C17H14F2N2O5/c18-11-3-9(4-12(19)5-11)1-2-10-7-21(17(25)20-16(10)24)15-6-13(23)14(8-22)26-15/h3-5,7,13-15,22-23H,6,8H2,(H,20,24,25)/t13-,14+,15+/m0/s1
InChI key:
VJXVXULNRNTVSP-RRFJBIMHSA-N
SMILES:
OC[C@H]1O[C@H](C[C@@H]1O)n1cc(C#Cc2cc(F)cc(F)c2)c(=O)[nH]c1=O
Systematic name (3):
5-[(3,5-ジフルオロフェニル)エチニル]-2′-デオキシウリジン
5-[2-(3,5-ジフルオロフェニル)エチニル]-1-[(2R,4S,5R)-4-ヒドロキシ-5-(ヒドロキシメチル)オキソラン-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-(3,5-difluorophenyl)ethynyl]-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-1,2,3,4-tetrahydropyrimidine-2,4-dione
Other name (1):
5-[(3,5-Difluorophenyl)ethynyl]-2′-deoxyuridine
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