2-azanyl-9-[(2S,5S)-5-(hydroxymethyl)oxolan-2-yl]-1-(phenylcarbonyl)purin-6-one

Systemtic Name: 2-azanyl-9-[(2S,5S)-5-(hydroxymethyl)oxolan-2-yl]-1-(phenylcarbonyl)purin-6-one Openeye Name: 2-amino-1-benzoyl-9-[(2S,5S)-5-(hydroxymethyl)tetrahydrofuran-2-yl]purin-6-one CAS Name: 2-amino-1-benzoyl-9-[(2S,5S)-5-(hydroxymethyl)-2-oxolanyl]-6-purinone IUPAC Name: 2-amino-1-benzoyl-9-[(2S,5S)-5-(hydroxymethyl)oxolan-2-yl]purin-6-one Traditional Name: 2-amino-1-benzoyl-9-[(2S,5S)-5-methyloltetrahydrofuran-2-yl]purin-6-one Formula: C17H17N5O4 MolecularWeight: 355.34798

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1CO)N2C=NC3=C2N=C(N(C3=O)C(=O)C4=CC=CC=C4)N

Isomeric SMILES

C1C[C@H](O[C@@H]1CO)N2C=NC3=C2N=C(N(C3=O)C(=O)C4=CC=CC=C4)N

InChI

InChI=1S/C17H17N5O4/c18-17-20-14-13(19-9-21(14)12-7-6-11(8-23)26-12)16(25)22(17)15(24)10-4-2-1-3-5-10/h1-5,9,11-12,23H,6-8H2,(H2,18,20)/t11-,12-/m0/s1