1-methyl-2-[[(1R,2R)-2-oxidanylcyclopentyl]amino]-8-propyl-7H-purin-6-one

Systemtic Name: 1-methyl-2-[[(1R,2R)-2-oxidanylcyclopentyl]amino]-8-propyl-7H-purin-6-one Openeye Name: 2-[[(1R,2R)-2-hydroxycyclopentyl]amino]-1-methyl-8-propyl-7H-purin-6-one CAS Name: 2-[[(1R,2R)-2-hydroxycyclopentyl]amino]-1-methyl-8-propyl-7H-purin-6-one IUPAC Name: 2-[[(1R,2R)-2-hydroxycyclopentyl]amino]-1-methyl-8-propyl-7H-purin-6-one Traditional Name: 2-[[(1R,2R)-2-hydroxycyclopentyl]amino]-1-methyl-8-propyl-7H-purin-6-one Formula: C14H21N5O2 MolecularWeight: 291.34884

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=C(N1)C(=O)N(C(=N2)NC3CCCC3O)C

Isomeric SMILES

CCCC1=NC2=C(N1)C(=O)N(C(=N2)N[C@@H]3CCC[C@H]3O)C

InChI

InChI=1S/C14H21N5O2/c1-3-5-10-16-11-12(17-10)18-14(19(2)13(11)21)15-8-6-4-7-9(8)20/h8-9,20H,3-7H2,1-2H3,(H,15,18)(H,16,17)/t8-,9-/m1/s1