2-azanyl-9-[4-[[5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-3-oxidanyl-oxolan-2-yl]methoxy-(dipropylamino)phosphoryl]oxy-5-(hydroxymethyl)oxolan-2-yl]-3H-purin-6-one

Systemtic Name: 2-azanyl-9-[4-[[5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-3-oxidanyl-oxolan-2-yl]methoxy-(dipropylamino)phosphoryl]oxy-5-(hydroxymethyl)oxolan-2-yl]-3H-purin-6-one Openeye Name: 2-amino-9-[4-[[5-(4-amino-2-oxo-pyrimidin-1-yl)-3-hydroxy-tetrahydrofuran-2-yl]methoxy-(dipropylamino)phosphoryl]oxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-3H-purin-6-one CAS Name: 2-amino-9-[4-[[5-(4-amino-2-oxo-1-pyrimidinyl)-3-hydroxy-2-oxolanyl]methoxy-(dipropylamino)phosphoryl]oxy-5-(hydroxymethyl)-2-oxolanyl]-3H-purin-6-one IUPAC Name: 2-amino-9-[4-[[5-(4-amino-2-oxopyrimidin-1-yl)-3-hydroxyoxolan-2-yl]methoxy-(dipropylamino)phosphoryl]oxy-5-(hydroxymethyl)oxolan-2-yl]-3H-purin-6-one Traditional Name: 2-amino-9-[4-[[5-(4-amino-2-keto-pyrimidin-1-yl)-3-hydroxy-tetrahydrofuran-2-yl]methoxy-(dipropylamino)phosphoryl]oxy-5-methylol-tetrahydrofuran-2-yl]-3H-purin-6-one Formula: C25H38N9O9P MolecularWeight: 639.597881

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)P(=O)(OCC1C(CC(O1)N2C=CC(=NC2=O)N)O)OC3CC(OC3CO)N4C=NC5=C4NC(=NC5=O)N

Isomeric SMILES

CCCN(CCC)P(=O)(OCC1C(CC(O1)N2C=CC(=NC2=O)N)O)OC3CC(OC3CO)N4C=NC5=C4NC(=NC5=O)N

InChI

InChI=1S/C25H38N9O9P/c1-3-6-32(7-4-2)44(39,40-12-17-14(36)9-19(42-17)33-8-5-18(26)29-25(33)38)43-15-10-20(41-16(15)11-35)34-13-28-21-22(34)30-24(27)31-23(21)37/h5,8,13-17,19-20,35-36H,3-4,6-7,9-12H2,1-2H3,(H2,26,29,38)(H3,27,30,31,37)