2-(4-fluorophenyl)-1-(4-methylphenyl)-4-methylsulfanyl-6-oxidanylidene-pyrimidine-5-carboxylic acid

Systemtic Name: 2-(4-fluorophenyl)-1-(4-methylphenyl)-4-methylsulfanyl-6-oxidanylidene-pyrimidine-5-carboxylic acid Openeye Name: 2-(4-fluorophenyl)-4-methylsulfanyl-6-oxo-1-(p-tolyl)pyrimidine-5-carboxylic acid CAS Name: 2-(4-fluorophenyl)-1-(4-methylphenyl)-4-(methylthio)-6-oxo-5-pyrimidinecarboxylic acid IUPAC Name: 2-(4-fluorophenyl)-1-(4-methylphenyl)-4-methylsulfanyl-6-oxopyrimidine-5-carboxylic acid Traditional Name: 2-(4-fluorophenyl)-6-keto-4-(methylthio)-1-(p-tolyl)pyrimidine-5-carboxylic acid Formula: C19H15FN2O3S MolecularWeight: 370.397403

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NC(=C(C2=O)C(=O)O)SC)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NC(=C(C2=O)C(=O)O)SC)C3=CC=C(C=C3)F

InChI

InChI=1S/C19H15FN2O3S/c1-11-3-9-14(10-4-11)22-16(12-5-7-13(20)8-6-12)21-17(26-2)15(18(22)23)19(24)25/h3-10H,1-2H3,(H,24,25)