methyl 2-[2-[[(2R)-oxan-2-yl]methylsulfanyl]-4-oxidanylidene-1H-pyrimidin-6-yl]ethanoate

Systemtic Name: methyl 2-[2-[[(2R)-oxan-2-yl]methylsulfanyl]-4-oxidanylidene-1H-pyrimidin-6-yl]ethanoate Openeye Name: methyl 2-[4-oxo-2-[[(2R)-tetrahydropyran-2-yl]methylsulfanyl]-1H-pyrimidin-6-yl]acetate CAS Name: 2-[2-[[(2R)-2-oxanyl]methylthio]-4-oxo-1H-pyrimidin-6-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[[(2R)-oxan-2-yl]methylsulfanyl]-4-oxo-1H-pyrimidin-6-yl]acetate Traditional Name: 2-[4-keto-2-[[(2R)-tetrahydropyran-2-yl]methylthio]-1H-pyrimidin-6-yl]acetic acid methyl ester Formula: C13H18N2O4S MolecularWeight: 298.35802

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=CC(=O)N=C(N1)SCC2CCCCO2

Isomeric SMILES

COC(=O)CC1=CC(=O)N=C(N1)SC[C@H]2CCCCO2

InChI

InChI=1S/C13H18N2O4S/c1-18-12(17)7-9-6-11(16)15-13(14-9)20-8-10-4-2-3-5-19-10/h6,10H,2-5,7-8H2,1H3,(H,14,15,16)/t10-/m1/s1