4-fluoranyl-3-[(2-oxidanylidenepyrimidin-1-yl)methyl]-1-benzothiophene-2-carboxylic acid

Systemtic Name: 4-fluoranyl-3-[(2-oxidanylidenepyrimidin-1-yl)methyl]-1-benzothiophene-2-carboxylic acid Openeye Name: 4-fluoro-3-[(2-oxopyrimidin-1-yl)methyl]benzothiophene-2-carboxylic acid CAS Name: 4-fluoro-3-[(2-oxo-1-pyrimidinyl)methyl]-1-benzothiophene-2-carboxylic acid IUPAC Name: 4-fluoro-3-[(2-oxopyrimidin-1-yl)methyl]-1-benzothiophene-2-carboxylic acid Traditional Name: 4-fluoro-3-[(2-ketopyrimidin-1-yl)methyl]benzothiophene-2-carboxylic acid Formula: C14H9FN2O3S MolecularWeight: 304.296263

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C(=C1)SC(=C2CN3C=CC=NC3=O)C(=O)O)F

Isomeric SMILES

C1=CC(=C2C(=C1)SC(=C2CN3C=CC=NC3=O)C(=O)O)F

InChI

InChI=1S/C14H9FN2O3S/c15-9-3-1-4-10-11(9)8(12(21-10)13(18)19)7-17-6-2-5-16-14(17)20/h1-6H,7H2,(H,18,19)