4-methylsulfanyl-1-(4-methylsulfanylphenyl)-6-oxidanylidene-2-phenyl-pyrimidine-5-carboxylic acid

Systemtic Name: 4-methylsulfanyl-1-(4-methylsulfanylphenyl)-6-oxidanylidene-2-phenyl-pyrimidine-5-carboxylic acid Openeye Name: 4-methylsulfanyl-1-(4-methylsulfanylphenyl)-6-oxo-2-phenyl-pyrimidine-5-carboxylic acid CAS Name: 4-(methylthio)-1-[4-(methylthio)phenyl]-6-oxo-2-phenyl-5-pyrimidinecarboxylic acid IUPAC Name: 4-methylsulfanyl-1-(4-methylsulfanylphenyl)-6-oxo-2-phenylpyrimidine-5-carboxylic acid Traditional Name: 6-keto-4-(methylthio)-1-[4-(methylthio)phenyl]-2-phenyl-pyrimidine-5-carboxylic acid Formula: C19H16N2O3S2 MolecularWeight: 384.47194

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)N2C(=NC(=C(C2=O)C(=O)O)SC)C3=CC=CC=C3

Isomeric SMILES

CSC1=CC=C(C=C1)N2C(=NC(=C(C2=O)C(=O)O)SC)C3=CC=CC=C3

InChI

InChI=1S/C19H16N2O3S2/c1-25-14-10-8-13(9-11-14)21-16(12-6-4-3-5-7-12)20-17(26-2)15(18(21)22)19(23)24/h3-11H,1-2H3,(H,23,24)