Chem
J-GLOBAL ID：200907002908127288   Nikkaji number：J1.402.656H

1-[(1R,2R)-1-Methyl-2-hydroxy-2-(2,4-difluorophenyl)-3-(1H-1,2,4-triazole-1-yl)propyl]-3-[4-(2-methyl-4-thiazolyl)phenyl]-4-imidazoline-2-one

1-[(1R,2R)-1-メチル-2-ヒドロキシ-2-(2,4-ジフルオロフェニル)-3-(1H-1,2,4-トリアゾール-1-イル)プロピル]-3-[4-(2-メチル-4-チアゾリル)フェニル]-4-イミダゾリン-2-オン
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： C25H22F2N6O2S
Molecular formula furigana： C25-H22-F2-N6-O2-S
Molecular weight： 508.550
InChI： InChI=1S/C25H22F2N6O2S/c1-16(25(35,13-31-15-28-14-29-31)21-8-5-19(26)11-22(21)27)32-9-10-33(24(32)34)20-6-3-18(4-7-20)23-12-36-17(2)30-23/h3-12,14-16,35H,13H2,1-2H3/t16-,25-/m1/s1
InChI key： JOESDQOUMIMEHE-PUAOIOHZSA-N
SMILES： C[C@@H](n1ccn(c2ccc(cc2)c2csc(C)n2)c1=O)[C@](O)(Cn1cncn1)c1ccc(F)cc1F
Systematic name  (3)：
  • 1-[(1R,2R)-1-メチル-2-ヒドロキシ-2-(2,4-ジフルオロフェニル)-3-(1H-1,2,4-トリアゾール-1-イル)プロピル]-3-[4-(2-メチル-4-チアゾリル)フェニル]-4-イミダゾリン-2-オン
  • 1-[(2R,3R)-3-(2,4-ジフルオロフェニル)-3-ヒドロキシ-4-(1H-1,2,4-トリアゾール-1-イル)ブタン-2-イル]-3-[4-(2-メチル-1,3-チアゾール-4-イル)フェニル]-2,3-ジヒドロ-1H-イミダゾール-2-オン
  • 1-[(2R,3R)-3-(2,4-difluorophenyl)-3-hydroxy-4-(1H-1,2,4-triazol-1-yl)butan-2-yl]-3-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]-2,3-dihydro-1H-imidazol-2-one
Other name (1)：
  • 1-[(1R,2R)-1-Methyl-2-hydroxy-2-(2,4-difluorophenyl)-3-(1H-1,2,4-triazole-1-yl)propyl]-3-[4-(2-methyl-4-thiazolyl)phenyl]-4-imidazoline-2-one
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