3-[[2,6-bis(oxidanylidene)-3-(oxolan-2-yl)pyrimidin-1-yl]methyl]thiophene-2-carboxylic acid

Systemtic Name: 3-[[2,6-bis(oxidanylidene)-3-(oxolan-2-yl)pyrimidin-1-yl]methyl]thiophene-2-carboxylic acid Openeye Name: 3-[(2,6-dioxo-3-tetrahydrofuran-2-yl-pyrimidin-1-yl)methyl]thiophene-2-carboxylic acid CAS Name: 3-[[2,6-dioxo-3-(2-oxolanyl)-1-pyrimidinyl]methyl]-2-thiophenecarboxylic acid IUPAC Name: 3-[[2,6-dioxo-3-(oxolan-2-yl)pyrimidin-1-yl]methyl]thiophene-2-carboxylic acid Traditional Name: 3-[[2,6-diketo-3-(tetrahydrofuryl)pyrimidin-1-yl]methyl]-2-thenoic acid Formula: C14H14N2O5S MolecularWeight: 322.33636

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)N2C=CC(=O)N(C2=O)CC3=C(SC=C3)C(=O)O

Isomeric SMILES

C1CC(OC1)N2C=CC(=O)N(C2=O)CC3=C(SC=C3)C(=O)O

InChI

InChI=1S/C14H14N2O5S/c17-10-3-5-15(11-2-1-6-21-11)14(20)16(10)8-9-4-7-22-12(9)13(18)19/h3-5,7,11H,1-2,6,8H2,(H,18,19)