[(2R,3S,4R,5R,6R)-5-acetamido-3,4-diacetyloxy-6-(5-bromanyl-2-methylsulfanyl-4-oxidanylidene-pyrimidin-1-yl)oxan-2-yl]methyl ethanoate

Systemtic Name: [(2R,3S,4R,5R,6R)-5-acetamido-3,4-diacetyloxy-6-(5-bromanyl-2-methylsulfanyl-4-oxidanylidene-pyrimidin-1-yl)oxan-2-yl]methyl ethanoate Openeye Name: [(2R,3S,4R,5R,6R)-5-acetamido-3,4-diacetoxy-6-(5-bromo-2-methylsulfanyl-4-oxo-pyrimidin-1-yl)tetrahydropyran-2-yl]methyl acetate CAS Name: acetic acid [(2R,3S,4R,5R,6R)-5-acetamido-3,4-diacetyloxy-6-[5-bromo-2-(methylthio)-4-oxo-1-pyrimidinyl]-2-oxanyl]methyl ester IUPAC Name: [(2R,3S,4R,5R,6R)-5-acetamido-3,4-diacetyloxy-6-(5-bromo-2-methylsulfanyl-4-oxopyrimidin-1-yl)oxan-2-yl]methyl acetate Traditional Name: acetic acid [(2R,3S,4R,5R,6R)-5-acetamido-3,4-diacetoxy-6-[5-bromo-4-keto-2-(methylthio)pyrimidin-1-yl]tetrahydropyran-2-yl]methyl ester Formula: C19H24BrN3O9S MolecularWeight: 550.37756

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1C(C(C(OC1N2C=C(C(=O)N=C2SC)Br)COC(=O)C)OC(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)N[C@@H]1[C@H]([C@@H]([C@H](O[C@H]1N2C=C(C(=O)N=C2SC)Br)COC(=O)C)OC(=O)C)OC(=O)C

InChI

InChI=1S/C19H24BrN3O9S/c1-8(24)21-14-16(31-11(4)27)15(30-10(3)26)13(7-29-9(2)25)32-18(14)23-6-12(20)17(28)22-19(23)33-5/h6,13-16,18H,7H2,1-5H3,(H,21,24)/t13-,14-,15-,16-,18-/m1/s1