Chem
J-GLOBAL ID:201307006694436073
Nikkaji number:J3.190.696B
GDC-0032
タセリシブ
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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:
C24 H28 N8 O2
Molecular formula furigana:
C24-H28-N8-O2
Molecular weight:
460.542
InChI:
InChI=1S/C24H28N8O2/c1-14(2)32-22(27-15(3)29-32)19-13-30-8-9-34-20-10-16(6-7-18(20)21(30)28-19)17-11-26-31(12-17)24(4,5)23(25)33/h6-7,10-14H,8-9H2,1-5H3,(H2,25,33)
InChI key:
BEUQXVWXFDOSAQ-UHFFFAOYSA-N
SMILES:
CC(C)n1nc(C)nc1c1cn2CCOc3cc(ccc3c2n1)c1cnn(c1)C(C)(C)C(=O)N
Systematic name (3):
4-(1-イソプロピル-3-メチル-1H-1,2,4-トリアゾール-5-イル)-12-[1-(1,1-ジメチル-2-アミノ-2-オキソエチル)-1H-ピラゾール-4-イル]-9-オキサ-3,6-ジアザトリシクロ[8.4.0.02,6 ]テトラデカン-1(14),2,4,10,12-ペンタエン
2-メチル-2-(4-{4-[3-メチル-1-(プロパン-2-イル)-1H-1,2,4-トリアゾール-5-イル]-9-オキサ-3,6-ジアザトリシクロ[8.4.0.02,6 ]テトラデカ-1(14),2,4,10,12-ペンタエン-12-イル}-1H-ピラゾール-1-イル)プロパンアミド
2-methyl-2-(4-{4-[3-methyl-1-(propan-2-yl)-1H-1,2,4-triazol-5-yl]-9-oxa-3,6-diazatricyclo[8.4.0.02,6 ]tetradeca-1(14),2,4,10,12-pentaen-12-yl}-1H-pyrazol-1-yl)propanamide
Other name (4):
4-(1-Isopropyl-3-methyl-1H-1,2,4-triazole-5-yl)-12-[1-(1,1-dimethyl-2-amino-2-oxoethyl)-1H-pyrazole-4-yl]-9-oxa-3,6-diazatricyclo[8.4.0.02,6 ]tetradecane-1(14),2,4,10,12-pentaene
GDC-0032
タセリシブ
Taselisib
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