[(2R,3R,4R,5R)-5-[2,4-bis(oxidanylidene)pyrimidin-1-yl]-3-oxidanyl-4-(propyldisulfanyl)oxolan-2-yl]methyl phosphono hydrogen phosphate

Systemtic Name: [(2R,3R,4R,5R)-5-[2,4-bis(oxidanylidene)pyrimidin-1-yl]-3-oxidanyl-4-(propyldisulfanyl)oxolan-2-yl]methyl phosphono hydrogen phosphate Openeye Name: [(2R,3R,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3-hydroxy-4-(propyldisulfanyl)tetrahydrofuran-2-yl]methyl phosphono hydrogen phosphate CAS Name: [(2R,3R,4R,5R)-5-(2,4-dioxo-1-pyrimidinyl)-3-hydroxy-4-(propyldisulfanyl)-2-oxolanyl]methyl phosphono hydrogen phosphate IUPAC Name: [(2R,3R,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3-hydroxy-4-(propyldisulfanyl)oxolan-2-yl]methyl phosphono hydrogen phosphate Traditional Name: [(2R,3R,4R,5R)-5-(2,4-diketopyrimidin-1-yl)-3-hydroxy-4-(propyldisulfanyl)tetrahydrofuran-2-yl]methyl phosphono hydrogen phosphate Formula: C12H20N2O11P2S2 MolecularWeight: 494.371522

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Descriptors Computed from Structure

Canonical SMILES:

CCCSSC1C(C(OC1N2C=CC(=O)NC2=O)COP(=O)(O)OP(=O)(O)O)O

Isomeric SMILES

CCCSS[C@@H]1[C@@H]([C@H](O[C@H]1N2C=CC(=O)NC2=O)COP(=O)(O)OP(=O)(O)O)O

InChI

InChI=1S/C12H20N2O11P2S2/c1-2-5-28-29-10-9(16)7(6-23-27(21,22)25-26(18,19)20)24-11(10)14-4-3-8(15)13-12(14)17/h3-4,7,9-11,16H,2,5-6H2,1H3,(H,21,22)(H,13,15,17)(H2,18,19,20)/t7-,9-,10-,11-/m1/s1