[(1R,2S,3R,4R)-4-[2,4-bis(oxidanylidene)-5-thiophen-3-yl-pyrimidin-1-yl]-2,3-bis(oxidanyl)cyclopentyl]methyl ethanoate

Systemtic Name: [(1R,2S,3R,4R)-4-[2,4-bis(oxidanylidene)-5-thiophen-3-yl-pyrimidin-1-yl]-2,3-bis(oxidanyl)cyclopentyl]methyl ethanoate Openeye Name: [(1R,2S,3R,4R)-4-[2,4-dioxo-5-(3-thienyl)pyrimidin-1-yl]-2,3-dihydroxy-cyclopentyl]methyl acetate CAS Name: acetic acid [(1R,2S,3R,4R)-4-[2,4-dioxo-5-(3-thiophenyl)-1-pyrimidinyl]-2,3-dihydroxycyclopentyl]methyl ester IUPAC Name: [(1R,2S,3R,4R)-4-(2,4-dioxo-5-thiophen-3-ylpyrimidin-1-yl)-2,3-dihydroxycyclopentyl]methyl acetate Traditional Name: acetic acid [(1R,2S,3R,4R)-4-[2,4-diketo-5-(3-thienyl)pyrimidin-1-yl]-2,3-dihydroxy-cyclopentyl]methyl ester Formula: C16H18N2O6S MolecularWeight: 366.38892

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1CC(C(C1O)O)N2C=C(C(=O)NC2=O)C3=CSC=C3

Isomeric SMILES

CC(=O)OC[C@H]1C[C@H]([C@H]([C@H]1O)O)N2C=C(C(=O)NC2=O)C3=CSC=C3

InChI

InChI=1S/C16H18N2O6S/c1-8(19)24-6-10-4-12(14(21)13(10)20)18-5-11(9-2-3-25-7-9)15(22)17-16(18)23/h2-3,5,7,10,12-14,20-21H,4,6H2,1H3,(H,17,22,23)/t10-,12-,13+,14-/m1/s1