2-[2-(6-azanyl-9-cyclobutyl-purin-2-yl)ethynyl]adamantan-1-ol

Systemtic Name: 2-[2-(6-azanyl-9-cyclobutyl-purin-2-yl)ethynyl]adamantan-1-ol Openeye Name: 2-[2-(6-amino-9-cyclobutyl-purin-2-yl)ethynyl]adamantan-1-ol CAS Name: 2-[2-(6-amino-9-cyclobutyl-2-purinyl)ethynyl]-1-adamantanol IUPAC Name: 2-[2-(6-amino-9-cyclobutylpurin-2-yl)ethynyl]adamantan-1-ol Traditional Name: 2-[2-(6-amino-9-cyclobutyl-purin-2-yl)ethynyl]adamantan-1-ol Formula: C21H25N5O MolecularWeight: 363.4561

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)N2C=NC3=C2N=C(N=C3N)C#CC4C5CC6CC(C5)CC4(C6)O

Isomeric SMILES

C1CC(C1)N2C=NC3=C2N=C(N=C3N)C#CC4C5CC6CC(C5)CC4(C6)O

InChI

InChI=1S/C21H25N5O/c22-19-18-20(26(11-23-18)15-2-1-3-15)25-17(24-19)5-4-16-14-7-12-6-13(8-14)10-21(16,27)9-12/h11-16,27H,1-3,6-10H2,(H2,22,24,25)