(1S,3R)-1-[2-(6-azanyl-9-cyclopentyl-purin-2-yl)ethynyl]-3-methyl-cyclohexan-1-ol

Systemtic Name: (1S,3R)-1-[2-(6-azanyl-9-cyclopentyl-purin-2-yl)ethynyl]-3-methyl-cyclohexan-1-ol Openeye Name: (1S,3R)-1-[2-(6-amino-9-cyclopentyl-purin-2-yl)ethynyl]-3-methyl-cyclohexanol CAS Name: (1S,3R)-1-[2-(6-amino-9-cyclopentyl-2-purinyl)ethynyl]-3-methyl-1-cyclohexanol IUPAC Name: (1S,3R)-1-[2-(6-amino-9-cyclopentylpurin-2-yl)ethynyl]-3-methylcyclohexan-1-ol Traditional Name: (1S,3R)-1-[2-(6-amino-9-cyclopentyl-purin-2-yl)ethynyl]-3-methyl-cyclohexanol Formula: C19H25N5O MolecularWeight: 339.4347

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1)(C#CC2=NC3=C(C(=N2)N)N=CN3C4CCCC4)O

Isomeric SMILES

C[C@@H]1CCC[C@](C1)(C#CC2=NC3=C(C(=N2)N)N=CN3C4CCCC4)O

InChI

InChI=1S/C19H25N5O/c1-13-5-4-9-19(25,11-13)10-8-15-22-17(20)16-18(23-15)24(12-21-16)14-6-2-3-7-14/h12-14,25H,2-7,9,11H2,1H3,(H2,20,22,23)/t13-,19-/m1/s1