N-[(2S,3S,5R)-2-(hydroxymethyl)-5-[2-(2-methylpropylamino)-6-oxidanylidene-3H-purin-9-yl]oxolan-3-yl]-[[(2R,3S,5R)-5-[5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]-3-oxidanyl-oxolan-2-yl]methoxy]phosphonamidic acid

Systemtic Name: N-[(2S,3S,5R)-2-(hydroxymethyl)-5-[2-(2-methylpropylamino)-6-oxidanylidene-3H-purin-9-yl]oxolan-3-yl]-[[(2R,3S,5R)-5-[5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]-3-oxidanyl-oxolan-2-yl]methoxy]phosphonamidic acid Openeye Name: [(2R,3S,5R)-3-hydroxy-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-2-yl]methoxy-N-[(2S,3S,5R)-2-(hydroxymethyl)-5-[2-(isobutylamino)-6-oxo-3H-purin-9-yl]tetrahydrofuran-3-yl]phosphonamidic acid CAS Name: [(2R,3S,5R)-3-hydroxy-5-(5-methyl-2,4-dioxo-1-pyrimidinyl)-2-oxolanyl]methoxy-N-[(2S,3S,5R)-2-(hydroxymethyl)-5-[2-(2-methylpropylamino)-6-oxo-3H-purin-9-yl]-3-oxolanyl]phosphonamidic acid IUPAC Name: [(2R,3S,5R)-3-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-N-[(2S,3S,5R)-2-(hydroxymethyl)-5-[2-(2-methylpropylamino)-6-oxo-3H-purin-9-yl]oxolan-3-yl]phosphonamidic acid Traditional Name: [(2R,3S,5R)-5-(2,4-diketo-5-methyl-pyrimidin-1-yl)-3-hydroxy-tetrahydrofuran-2-yl]methoxy-N-[(2S,3S,5R)-5-[2-(isobutylamino)-6-keto-3H-purin-9-yl]-2-methylol-tetrahydrofuran-3-yl]phosphonamidic acid Formula: C24H35N8O10P MolecularWeight: 626.556061

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=O)NC1=O)C2CC(C(O2)COP(=O)(NC3CC(OC3CO)N4C=NC5=C4NC(=NC5=O)NCC(C)C)O)O

Isomeric SMILES

CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)COP(=O)(N[C@H]3C[C@@H](O[C@@H]3CO)N4C=NC5=C4NC(=NC5=O)NCC(C)C)O)O

InChI

InChI=1S/C24H35N8O10P/c1-11(2)6-25-23-27-20-19(22(36)28-23)26-10-32(20)17-4-13(15(8-33)41-17)30-43(38,39)40-9-16-14(34)5-18(42-16)31-7-12(3)21(35)29-24(31)37/h7,10-11,13-18,33-34H,4-6,8-9H2,1-3H3,(H,29,35,37)(H2,30,38,39)(H2,25,27,28,36)/t13-,14-,15+,16+,17+,18+/m0/s1