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

Systemtic Name: 2-[2-[6-azanyl-9-(2-hydroxyethyl)purin-2-yl]ethynyl]adamantan-1-ol Openeye Name: 2-[2-[6-amino-9-(2-hydroxyethyl)purin-2-yl]ethynyl]adamantan-1-ol CAS Name: 2-[2-[6-amino-9-(2-hydroxyethyl)-2-purinyl]ethynyl]-1-adamantanol IUPAC Name: 2-[2-[6-amino-9-(2-hydroxyethyl)purin-2-yl]ethynyl]adamantan-1-ol Traditional Name: 2-[2-[6-amino-9-(2-hydroxyethyl)purin-2-yl]ethynyl]adamantan-1-ol Formula: C19H23N5O2 MolecularWeight: 353.41822

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3C#CC4=NC5=C(C(=N4)N)N=CN5CCO)O

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3C#CC4=NC5=C(C(=N4)N)N=CN5CCO)O

InChI

InChI=1S/C19H23N5O2/c20-17-16-18(24(3-4-25)10-21-16)23-15(22-17)2-1-14-13-6-11-5-12(7-13)9-19(14,26)8-11/h10-14,25-26H,3-9H2,(H2,20,22,23)