9-[(1R,2R,3S)-2,3-bis(hydroxymethyl)cyclobutyl]-2-(2-methylpropylamino)-3H-purin-6-one

Systemtic Name: 9-[(1R,2R,3S)-2,3-bis(hydroxymethyl)cyclobutyl]-2-(2-methylpropylamino)-3H-purin-6-one Openeye Name: 9-[(1R,2R,3S)-2,3-bis(hydroxymethyl)cyclobutyl]-2-(isobutylamino)-3H-purin-6-one CAS Name: 9-[(1R,2R,3S)-2,3-bis(hydroxymethyl)cyclobutyl]-2-(2-methylpropylamino)-3H-purin-6-one IUPAC Name: 9-[(1R,2R,3S)-2,3-bis(hydroxymethyl)cyclobutyl]-2-(2-methylpropylamino)-3H-purin-6-one Traditional Name: 9-[(1R,2R,3S)-2,3-dimethylolcyclobutyl]-2-(isobutylamino)-3H-purin-6-one Formula: C15H23N5O3 MolecularWeight: 321.37482

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC1=NC(=O)C2=C(N1)N(C=N2)C3CC(C3CO)CO

Isomeric SMILES

CC(C)CNC1=NC(=O)C2=C(N1)N(C=N2)[C@@H]3C[C@@H]([C@H]3CO)CO

InChI

InChI=1S/C15H23N5O3/c1-8(2)4-16-15-18-13-12(14(23)19-15)17-7-20(13)11-3-9(5-21)10(11)6-22/h7-11,21-22H,3-6H2,1-2H3,(H2,16,18,19,23)/t9-,10-,11-/m1/s1