2-[(4-azanylidene-1-oxidanyl-quinolin-3-yl)amino]-9-[(4S,5R)-5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-3H-purin-6-one

Systemtic Name: 2-[(4-azanylidene-1-oxidanyl-quinolin-3-yl)amino]-9-[(4S,5R)-5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-3H-purin-6-one Openeye Name: 9-[(4S,5R)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-2-[(1-hydroxy-4-imino-3-quinolyl)amino]-3H-purin-6-one CAS Name: 9-[(4S,5R)-4-hydroxy-5-(hydroxymethyl)-2-oxolanyl]-2-[(1-hydroxy-4-imino-3-quinolinyl)amino]-3H-purin-6-one IUPAC Name: 9-[(4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-[(1-hydroxy-4-iminoquinolin-3-yl)amino]-3H-purin-6-one Traditional Name: 2-[(1-hydroxy-4-imino-3-quinolyl)amino]-9-[(4S,5R)-4-hydroxy-5-methylol-tetrahydrofuran-2-yl]-3H-purin-6-one Formula: C19H19N7O5 MolecularWeight: 425.39806

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC1N2C=NC3=C2NC(=NC3=O)NC4=CN(C5=CC=CC=C5C4=N)O)CO)O

Isomeric SMILES

C1[C@@H]([C@H](OC1N2C=NC3=C2NC(=NC3=O)NC4=CN(C5=CC=CC=C5C4=N)O)CO)O

InChI

InChI=1S/C19H19N7O5/c20-15-9-3-1-2-4-11(9)26(30)6-10(15)22-19-23-17-16(18(29)24-19)21-8-25(17)14-5-12(28)13(7-27)31-14/h1-4,6,8,12-14,20,27-28,30H,5,7H2,(H2,22,23,24,29)/t12-,13+,14?/m0/s1