2-azanyl-9-[(E)-[2-fluoranyl-3-(hydroxymethyl)cyclopropylidene]methyl]-3H-purin-6-one

Systemtic Name: 2-azanyl-9-[(E)-[2-fluoranyl-3-(hydroxymethyl)cyclopropylidene]methyl]-3H-purin-6-one Openeye Name: 2-amino-9-[(E)-[2-fluoro-3-(hydroxymethyl)cyclopropylidene]methyl]-3H-purin-6-one CAS Name: 2-amino-9-[(E)-[2-fluoro-3-(hydroxymethyl)cyclopropylidene]methyl]-3H-purin-6-one IUPAC Name: 2-amino-9-[(E)-[2-fluoro-3-(hydroxymethyl)cyclopropylidene]methyl]-3H-purin-6-one Traditional Name: 2-amino-9-[(E)-(2-fluoro-3-methylol-cyclopropylidene)methyl]-3H-purin-6-one Formula: C10H10FN5O2 MolecularWeight: 251.217103

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(N1C=C3C(C3F)CO)NC(=NC2=O)N

Isomeric SMILES

C1=NC2=C(N1/C=C/3\C(C3F)CO)NC(=NC2=O)N

InChI

InChI=1S/C10H10FN5O2/c11-6-4(5(6)2-17)1-16-3-13-7-8(16)14-10(12)15-9(7)18/h1,3,5-6,17H,2H2,(H3,12,14,15,18)/b4-1+