4-[6-azanyl-9-(4-dimethylaminophenyl)-8-(3-fluorophenyl)purin-2-yl]-2-methyl-butan-2-ol

Systemtic Name: 4-[6-azanyl-9-(4-dimethylaminophenyl)-8-(3-fluorophenyl)purin-2-yl]-2-methyl-butan-2-ol Openeye Name: 4-[6-amino-9-(4-dimethylaminophenyl)-8-(3-fluorophenyl)purin-2-yl]-2-methyl-butan-2-ol CAS Name: 4-[6-amino-9-(4-dimethylaminophenyl)-8-(3-fluorophenyl)-2-purinyl]-2-methyl-2-butanol IUPAC Name: 4-[6-amino-9-(4-dimethylaminophenyl)-8-(3-fluorophenyl)purin-2-yl]-2-methylbutan-2-ol Traditional Name: 4-[6-amino-9-(4-dimethylaminophenyl)-8-(3-fluorophenyl)purin-2-yl]-2-methyl-butan-2-ol Formula: C24H27FN6O MolecularWeight: 434.509183

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCC1=NC2=C(C(=N1)N)N=C(N2C3=CC=C(C=C3)N(C)C)C4=CC(=CC=C4)F)O

Isomeric SMILES

CC(C)(CCC1=NC2=C(C(=N1)N)N=C(N2C3=CC=C(C=C3)N(C)C)C4=CC(=CC=C4)F)O

InChI

InChI=1S/C24H27FN6O/c1-24(2,32)13-12-19-27-21(26)20-23(28-19)31(18-10-8-17(9-11-18)30(3)4)22(29-20)15-6-5-7-16(25)14-15/h5-11,14,32H,12-13H2,1-4H3,(H2,26,27,28)