2-azanyl-9-[5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]-8-(4-phenylpiperazin-1-yl)-3H-purin-6-one

Systemtic Name: 2-azanyl-9-[5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]-8-(4-phenylpiperazin-1-yl)-3H-purin-6-one Openeye Name: 2-amino-9-[3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-8-(4-phenylpiperazin-1-yl)-3H-purin-6-one CAS Name: 2-amino-9-[3,4-dihydroxy-5-(hydroxymethyl)-2-oxolanyl]-8-(4-phenyl-1-piperazinyl)-3H-purin-6-one IUPAC Name: 2-amino-9-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-8-(4-phenylpiperazin-1-yl)-3H-purin-6-one Traditional Name: 2-amino-9-(3,4-dihydroxy-5-methylol-tetrahydrofuran-2-yl)-8-(4-phenylpiperazino)-3H-purin-6-one Formula: C20H25N7O5 MolecularWeight: 443.4564

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C3=NC4=C(N3C5C(C(C(O5)CO)O)O)NC(=NC4=O)N

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C3=NC4=C(N3C5C(C(C(O5)CO)O)O)NC(=NC4=O)N

InChI

InChI=1S/C20H25N7O5/c21-19-23-16-13(17(31)24-19)22-20(27(16)18-15(30)14(29)12(10-28)32-18)26-8-6-25(7-9-26)11-4-2-1-3-5-11/h1-5,12,14-15,18,28-30H,6-10H2,(H3,21,23,24,31)