Chem
J-GLOBAL ID：201507021837791752   Nikkaji number：J3.340.008J

GDC-0834

N-[2-メチル-3-[6-[[4-[(3R)-1,4-ジメチル-2-オキソピペラジン-3-イル]フェニル]アミノ]-4-メチル-5-オキソ-4,5-ジヒドロピラジン-2-イル]フェニル]-4,5,6,7-テトラヒドロベンゾ[b]チオフェン-2-カルボアミド
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： C33H36N6O3S
Molecular formula furigana： C33-H36-N6-O3-S
Molecular weight： 596.750
InChI： InChI=1S/C33H36N6O3S/c1-20-24(9-7-10-25(20)36-31(40)28-18-22-8-5-6-11-27(22)43-28)26-19-39(4)33(42)30(35-26)34-23-14-12-21(13-15-23)29-32(41)38(3)17-16-37(29)2/h7,9-10,12-15,18-19,29H,5-6,8,11,16-17H2,1-4H3,(H,34,35)(H,36,40)/t29-/m1/s1
InChI key： CDOOFZZILLRUQH-GDLZYMKVSA-N
SMILES： CN1CCN(C)C(=O)[C@H]1c1ccc(Nc2nc(cn(C)c2=O)c2cccc(NC(=O)c3cc4CCCCc4s3)c2C)cc1
Systematic name  (3)：
  • N-[2-メチル-3-[6-[[4-[(3R)-1,4-ジメチル-2-オキソピペラジン-3-イル]フェニル]アミノ]-4-メチル-5-オキソ-4,5-ジヒドロピラジン-2-イル]フェニル]-4,5,6,7-テトラヒドロベンゾ[b]チオフェン-2-カルボアミド
  • N-{3-[6-({4-[(2R)-1,4-ジメチル-3-オキソピペラジン-2-イル]フェニル}アミノ)-4-メチル-5-オキソ-4,5-ジヒドロピラジン-2-イル]-2-メチルフェニル}-4,5,6,7-テトラヒドロ-1-ベンゾチオフェン-2-カルボキサミド
  • N-{3-[6-({4-[(2R)-1,4-dimethyl-3-oxopiperazin-2-yl]phenyl}amino)-4-methyl-5-oxo-4,5-dihydropyrazin-2-yl]-2-methylphenyl}-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide
Other name (2)：
  • N-[2-Methyl-3-[6-[[4-[(3R)-1,4-dimethyl-2-oxopiperazine-3-yl]phenyl]amino]-4-methyl-5-oxo-4,5-dihydropyrazine-2-yl]phenyl]-4,5,6,7-tetrahydrobenzo[b]thiophene-2-carboxamide
  • GDC-0834
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