1-[4-[[5-(6-aminopurin-9-yl)-3-oxidanyl-oxolan-2-yl]methoxy-[3-(dimethylamino)propylamino]phosphoryl]oxy-5-(hydroxymethyl)oxolan-2-yl]-5-methyl-pyrimidine-2,4-dione

Systemtic Name: 1-[4-[[5-(6-aminopurin-9-yl)-3-oxidanyl-oxolan-2-yl]methoxy-[3-(dimethylamino)propylamino]phosphoryl]oxy-5-(hydroxymethyl)oxolan-2-yl]-5-methyl-pyrimidine-2,4-dione Openeye Name: 1-[4-[[5-(6-aminopurin-9-yl)-3-hydroxy-tetrahydrofuran-2-yl]methoxy-[3-(dimethylamino)propylamino]phosphoryl]oxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-5-methyl-pyrimidine-2,4-dione CAS Name: 1-[4-[[5-(6-aminopurin-9-yl)-3-hydroxy-2-oxolanyl]methoxy-[3-(dimethylamino)propylamino]phosphoryl]oxy-5-(hydroxymethyl)-2-oxolanyl]-5-methylpyrimidine-2,4-dione IUPAC Name: 1-[4-[[5-(6-aminopurin-9-yl)-3-hydroxyoxolan-2-yl]methoxy-[3-(dimethylamino)propylamino]phosphoryl]oxy-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione Traditional Name: 1-[4-[(5-adenin-9-yl-3-hydroxy-tetrahydrofuran-2-yl)methoxy-[3-(dimethylamino)propylamino]phosphoryl]oxy-5-methylol-tetrahydrofuran-2-yl]-5-methyl-pyrimidine-2,4-quinone Formula: C25H38N9O9P MolecularWeight: 639.597881

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=O)NC1=O)C2CC(C(O2)CO)OP(=O)(NCCCN(C)C)OCC3C(CC(O3)N4C=NC5=C4N=CN=C5N)O

Isomeric SMILES

CC1=CN(C(=O)NC1=O)C2CC(C(O2)CO)OP(=O)(NCCCN(C)C)OCC3C(CC(O3)N4C=NC5=C4N=CN=C5N)O

InChI

InChI=1S/C25H38N9O9P/c1-14-9-33(25(38)31-24(14)37)20-8-16(17(10-35)41-20)43-44(39,30-5-4-6-32(2)3)40-11-18-15(36)7-19(42-18)34-13-29-21-22(26)27-12-28-23(21)34/h9,12-13,15-20,35-36H,4-8,10-11H2,1-3H3,(H,30,39)(H2,26,27,28)(H,31,37,38)