化学生物学-高端化学-阿拉丁aladdin

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1,5-二(4-甲氧苯基)戊-1,4-二烯-3-酮
CAS号 : 2051-07-2 Compound CID : 715840

分子式: C₁₉H₁₈O₃ 分子量: 294.34

IUPAC Name: (1E,4E)-1,5-bis(4-methoxyphenyl)penta-1,4-dien-3-one

SMILES: COC1=CC=C(C=C1)C=CC(=O)C=CC2=CC=C(C=C2)OC

InChIKey: IOZVKDXPBWBUKY-LQIBPGRFSA-N

InChI: InChI=1S/C19H18O3/c1-21-18-11-5-15(6-12-18)3-9-17(20)10-4-16-7-13-19(22-2)14-8-16/h3-14H,1-2H3/b9-3+,10-4+

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LSN2463359,mGlu5受体的正变构调节剂
- ≥98%(HPLC)
CAS号 : 1401031-52-4 Compound CID : 72551298

分子式: C₁₆H₁₅N₃O 分子量: 265.31

IUPAC Name: N-propan-2-yl-5-(2-pyridin-4-ylethynyl)pyridine-2-carboxamide

SMILES: CC(C)NC(=O)C1=NC=C(C=C1)C#CC2=CC=NC=C2

InChIKey: STAFRSGTRKNXHF-UHFFFAOYSA-N

InChI: InChI=1S/C16H15N3O/c1-12(2)19-16(20)15-6-5-14(11-18-15)4-3-13-7-9-17-10-8-13/h5-12H,1-2H3,(H,19,20)
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外消旋托法替尼
- ≥97%
CAS号 : 1259404-17-5 Compound CID : 9926791

分子式: C₁₆H₂₀N₆O 分子量: 312.377

IUPAC Name: 3-[(3R,4R)-4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]-3-oxopropanenitrile

SMILES: CC1CCN(CC1N(C)C2=NC=NC3=C2C=CN3)C(=O)CC#N

InChIKey: UJLAWZDWDVHWOW-YPMHNXCESA-N

InChI: InChI=1S/C16H20N6O/c1-11-5-8-22(14(23)3-6-17)9-13(11)21(2)16-12-4-7-18-15(12)19-10-20-16/h4,7,10-11,13H,3,5,8-9H2,1-2H3,(H,18,19,20)/t11-,13+/m1/s1
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