Chem
J-GLOBAL ID：201107080034158985   Nikkaji number：J2.929.351A

NBI-74330

2-[(R)-1-[[2-[3-(トリフルオロメチル)-4-フルオロフェニル]アセチル](3-ピリジニルメチル)アミノ]エチル]-3-(4-エトキシフェニル)ピリド[2,3-d]ピリミジン-4(3H)-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： C32H27F4N5O3
Molecular formula furigana： C32-H27-F4-N5-O3
Molecular weight： 605.594
InChI： InChI=1S/C32H27F4N5O3/c1-3-44-24-11-9-23(10-12-24)41-30(39-29-25(31(41)43)7-5-15-38-29)20(2)40(19-22-6-4-14-37-18-22)28(42)17-21-8-13-27(33)26(16-21)32(34,35)36/h4-16,18,20H,3,17,19H2,1-2H3/t20-/m1/s1
InChI key： XMRGQUDUVGRCBS-HXUWFJFHSA-N
SMILES： CCOc1ccc(cc1)n1c(nc2ncccc2c1=O)[C@@H](C)N(Cc1cccnc1)C(=O)Cc1ccc(F)c(c1)C(F)(F)F
Systematic name  (4)：
  • N-[(1R)-1-[3-(4-エトキシフェニル)-3,4-ジヒドロ-4-オキソピリド[2,3-d]ピリミジン-2-イル]エチル]-4-フルオロ-N-(3-ピリジルメチル)-3-(トリフルオロメチル)ベンゼンアセトアミド
  • 2-[(R)-1-[[2-[3-(トリフルオロメチル)-4-フルオロフェニル]アセチル](3-ピリジニルメチル)アミノ]エチル]-3-(4-エトキシフェニル)ピリド[2,3-d]ピリミジン-4(3H)-オン
  • N-[(1R)-1-[3-(4-エトキシフェニル)-4-オキソ-3H,4H-ピリド[2,3-d]ピリミジン-2-イル]エチル]-2-[4-フルオロ-3-(トリフルオロメチル)フェニル]-N-[(ピリジン-3-イル)メチル]アセトアミド
  • N-[(1R)-1-[3-(4-ethoxyphenyl)-4-oxo-3H,4H-pyrido[2,3-d]pyrimidin-2-yl]ethyl]-2-[4-fluoro-3-(trifluoromethyl)phenyl]-N-[(pyridin-3-yl)methyl]acetamide
Other name (3)：
  • N-[(1R)-1-[3-(4-Ethoxyphenyl)-3,4-dihydro-4-oxopyrido[2,3-d]pyrimidine-2-yl]ethyl]-4-fluoro-N-(3-pyridylmethyl)-3-(trifluoromethyl)benzeneacetamide
  • NBI-74330
  • 2-[(R)-1-[[2-[3-(Trifluoromethyl)-4-fluorophenyl]acetyl](3-pyridinylmethyl)amino]ethyl]-3-(4-ethoxyphenyl)pyrido[2,3-d]pyrimidine-4(3H)-one
CAS registry number： 855527-92-3
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