化学式

CAS号

IUPAC Name

7-丁-2-丙炔-8-[(3R)-3-(chloroamino)哌啶-1-基]-1-[(5-氟-1,3-苯并噻唑-2-基)甲基]-3-甲基嘌呤-2,6-二酮 7-but-2-ynyl-8-[(3R)-3-(chloroamino)piperidin-1-yl]-1-[(5-fluoro-1,3-benzothiazol-2-yl)methyl]-3-methylpurine-2,6-dione

InChI

InChI=1S/C23H23ClFN7O2S/c1-3-4-10-31-19-20(27-22(31)30-9-5-6-15(12-30)28-24)29(2)23(34)32(21(19)33)13-18-26-16-11-14(25)7-8-17(16)35-18/h7-8,11,15,28H,5-6,9-10,12-13H2,1-2H3/t15-/m1/s1

InChI Key

VDKKSQOQPXKGDE-OAHLLOKOSA-N

Canonical SMILES

CC#CCN1C2=C(N=C1N3CCCC(C3)NCl)N(C(=O)N(C2=O)CC4=NC5=C(S4)C=CC(=C5)F)C

别名

• SCHEMBL16677843