[3-acetyloxy-5-[2,4-bis(oxidanylidene)-5-thiocyanato-pyrimidin-1-yl]oxolan-2-yl]methyl ethanoate

Systemtic Name: [3-acetyloxy-5-[2,4-bis(oxidanylidene)-5-thiocyanato-pyrimidin-1-yl]oxolan-2-yl]methyl ethanoate Openeye Name: [3-acetoxy-5-(2,4-dioxo-5-thiocyanato-pyrimidin-1-yl)tetrahydrofuran-2-yl]methyl acetate CAS Name: acetic acid [3-acetyloxy-5-(2,4-dioxo-5-thiocyanato-1-pyrimidinyl)-2-oxolanyl]methyl ester IUPAC Name: [3-acetyloxy-5-(2,4-dioxo-5-thiocyanatopyrimidin-1-yl)oxolan-2-yl]methyl acetate Traditional Name: acetic acid [3-acetoxy-5-(2,4-diketo-5-thiocyanato-pyrimidin-1-yl)tetrahydrofuran-2-yl]methyl ester Formula: C14H15N3O7S MolecularWeight: 369.3498

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1C(CC(O1)N2C=C(C(=O)NC2=O)SC#N)OC(=O)C

Isomeric SMILES

CC(=O)OCC1C(CC(O1)N2C=C(C(=O)NC2=O)SC#N)OC(=O)C

InChI

InChI=1S/C14H15N3O7S/c1-7(18)22-5-10-9(23-8(2)19)3-12(24-10)17-4-11(25-6-15)13(20)16-14(17)21/h4,9-10,12H,3,5H2,1-2H3,(H,16,20,21)