2,8-dimethyl-9-(oxan-2-yl)-6-phenyl-purine

Systemtic Name: 2,8-dimethyl-9-(oxan-2-yl)-6-phenyl-purine Openeye Name: 2,8-dimethyl-6-phenyl-9-tetrahydropyran-2-yl-purine CAS Name: 2,8-dimethyl-9-(2-oxanyl)-6-phenylpurine IUPAC Name: 2,8-dimethyl-9-(oxan-2-yl)-6-phenylpurine Traditional Name: 2,8-dimethyl-6-phenyl-9-tetrahydropyran-2-yl-purine Formula: C18H20N4O MolecularWeight: 308.3776

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C2C(=N1)N(C(=N2)C)C3CCCCO3)C4=CC=CC=C4

Isomeric SMILES

CC1=NC(=C2C(=N1)N(C(=N2)C)C3CCCCO3)C4=CC=CC=C4

InChI

InChI=1S/C18H20N4O/c1-12-19-16(14-8-4-3-5-9-14)17-18(20-12)22(13(2)21-17)15-10-6-7-11-23-15/h3-5,8-9,15H,6-7,10-11H2,1-2H3