Chem
J-GLOBAL ID：200907015501734982   Nikkaji number：J1.750.712E

4-Amino-5-(4-phenoxyphenyl)-7-[4α-(4-methylpiperazino)cyclohexane-1α-yl]-7H-pyrrolo[2,3-d]pyrimidine

4-アミノ-5-(4-フェノキシフェニル)-7-[4α-(4-メチルピペラジノ)シクロヘキサン-1α-イル]-7H-ピロロ[2,3-d]ピリミジン
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： C29H34N6O
Molecular formula furigana： C29-H34-N6-O
Molecular weight： 482.632
InChI： InChI=1S/C29H34N6O/c1-33-15-17-34(18-16-33)22-9-11-23(12-10-22)35-19-26(27-28(30)31-20-32-29(27)35)21-7-13-25(14-8-21)36-24-5-3-2-4-6-24/h2-8,13-14,19-20,22-23H,9-12,15-18H2,1H3,(H2,30,31,32)/t22-,23+
InChI key： FDVSOQRNTAPCHB-ZRZAMGCNSA-N
SMILES： CN1CCN(CC1)[C@H]1CC[C@H](CC1)n1cc(c2ccc(Oc3ccccc3)cc2)c2c(N)ncnc12
Systematic name  (3)：
  • 4-アミノ-5-(4-フェノキシフェニル)-7-[4α-(4-メチルピペラジノ)シクロヘキサン-1α-イル]-7H-ピロロ[2,3-d]ピリミジン
  • 5-(4-フェノキシフェニル)-7-[(1s,4s)-4-(4-メチルピペラジン-1-イル)シクロヘキシル]-7H-ピロロ[2,3-d]ピリミジン-4-アミン
  • 5-(4-phenoxyphenyl)-7-[(1s,4s)-4-(4-methylpiperazin-1-yl)cyclohexyl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine
Other name (1)：
  • 4-Amino-5-(4-phenoxyphenyl)-7-[4α-(4-methylpiperazino)cyclohexane-1α-yl]-7H-pyrrolo[2,3-d]pyrimidine
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