9-[5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-2-(1-imidazol-1-ylpropylamino)-3H-purin-6-one

Systemtic Name: 9-[5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-2-(1-imidazol-1-ylpropylamino)-3H-purin-6-one Openeye Name: 9-[4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-2-(1-imidazol-1-ylpropylamino)-3H-purin-6-one CAS Name: 9-[4-hydroxy-5-(hydroxymethyl)-2-oxolanyl]-2-[1-(1-imidazolyl)propylamino]-3H-purin-6-one IUPAC Name: 9-[4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-(1-imidazol-1-ylpropylamino)-3H-purin-6-one Traditional Name: 9-(4-hydroxy-5-methylol-tetrahydrofuran-2-yl)-2-(1-imidazol-1-ylpropylamino)-3H-purin-6-one Formula: C16H21N7O4 MolecularWeight: 375.38244

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Descriptors Computed from Structure

Canonical SMILES:

CCC(NC1=NC(=O)C2=C(N1)N(C=N2)C3CC(C(O3)CO)O)N4C=CN=C4

Isomeric SMILES

CCC(NC1=NC(=O)C2=C(N1)N(C=N2)C3CC(C(O3)CO)O)N4C=CN=C4

InChI

InChI=1S/C16H21N7O4/c1-2-11(22-4-3-17-7-22)19-16-20-14-13(15(26)21-16)18-8-23(14)12-5-9(25)10(6-24)27-12/h3-4,7-12,24-25H,2,5-6H2,1H3,(H2,19,20,21,26)