Chem
J-GLOBAL ID：201207044048685768   Nikkaji number：J3.116.294G

Quizartinib

キザルチニブ
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： C29H32N6O4S
Molecular formula furigana： C29-H32-N6-O4-S
Molecular weight： 560.670
InChI： InChI=1S/C29H32N6O4S/c1-29(2,3)25-17-26(33-39-25)32-27(36)30-20-6-4-19(5-7-20)22-18-35-23-9-8-21(16-24(23)40-28(35)31-22)38-15-12-34-10-13-37-14-11-34/h4-9,16-18H,10-15H2,1-3H3,(H2,30,32,33,36)
InChI key： CVWXJKQAOSCOAB-UHFFFAOYSA-N
SMILES： CC(C)(C)c1cc(NC(=O)Nc2ccc(cc2)c2cn3c(n2)sc2cc(OCCN4CCOCC4)ccc32)no1
Systematic name  (4)：
  • N-(5-tert-ブチル-3-イソオキサゾリル)-N′-[4-[7-(2-モルホリノエトキシ)イミダゾ[2,1-b]ベンゾチアゾール-2-イル]フェニル]尿素
  • 1-(5-tert-ブチルイソオキサゾール-3-イル)-3-(4-(7-(2-(4-モルホリニル)エトキシ)イミダゾ[2,1-b]ベンゾチアゾール-2-イル)フェニル)尿素
  • 3-(5-tert-ブチル-1,2-オキサゾール-3-イル)-1-(4-{10-[2-(モルホリン-4-イル)エトキシ]-7-チア-2,5-ジアザトリシクロ[6.4.0.02,6]ドデカ-1(12),3,5,8,10-ペンタエン-4-イル}フェニル)尿素
  • 3-(5-tert-butyl-1,2-oxazol-3-yl)-1-(4-{10-[2-(morpholin-4-yl)ethoxy]-7-thia-2,5-diazatricyclo[6.4.0.02,6]dodeca-1(12),3,5,8,10-pentaen-4-yl}phenyl)urea
Other name (4)：
  • N-(5-tert-Butyl-3-isoxazolyl)-N′-[4-[7-(2-morpholinoethoxy)imidazo[2,1-b]benzothiazole-2-yl]phenyl]urea
  • キザルチニブ
  • Quizartinib
  • 1-(5-tert-Butylisoxazole-3-yl)-3-(4-(7-(2-(4-morpholinyl)ethoxy)imidazo[2,1-b]benzothiazole-2-yl)phenyl)urea
CAS registry number： 950769-58-1
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