3-[3-methyl-2,6-bis(oxidanylidene)-4-(trifluoromethyl)pyrimidin-1-yl]-1-benzothiophene-2-carboxylic acid

Systemtic Name: 3-[3-methyl-2,6-bis(oxidanylidene)-4-(trifluoromethyl)pyrimidin-1-yl]-1-benzothiophene-2-carboxylic acid Openeye Name: 3-[3-methyl-2,6-dioxo-4-(trifluoromethyl)pyrimidin-1-yl]benzothiophene-2-carboxylic acid CAS Name: 3-[3-methyl-2,6-dioxo-4-(trifluoromethyl)-1-pyrimidinyl]-1-benzothiophene-2-carboxylic acid IUPAC Name: 3-[3-methyl-2,6-dioxo-4-(trifluoromethyl)pyrimidin-1-yl]-1-benzothiophene-2-carboxylic acid Traditional Name: 3-[2,6-diketo-3-methyl-4-(trifluoromethyl)pyrimidin-1-yl]benzothiophene-2-carboxylic acid Formula: C15H9F3N2O4S MolecularWeight: 370.30317

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=O)N(C1=O)C2=C(SC3=CC=CC=C32)C(=O)O)C(F)(F)F

Isomeric SMILES

CN1C(=CC(=O)N(C1=O)C2=C(SC3=CC=CC=C32)C(=O)O)C(F)(F)F

InChI

InChI=1S/C15H9F3N2O4S/c1-19-9(15(16,17)18)6-10(21)20(14(19)24)11-7-4-2-3-5-8(7)25-12(11)13(22)23/h2-6H,1H3,(H,22,23)