2-[2-[(2,4-dimethylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-3-(2-fluorophenyl)-5-methyl-6-oxidanylidene-pyrimidin-4-olate

Systemtic Name: 2-[2-[(2,4-dimethylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-3-(2-fluorophenyl)-5-methyl-6-oxidanylidene-pyrimidin-4-olate Openeye Name: 2-[2-(2,4-dimethylanilino)-2-oxo-ethyl]sulfanyl-3-(2-fluorophenyl)-5-methyl-6-oxo-pyrimidin-4-olate CAS Name: 2-[[2-(2,4-dimethylanilino)-2-oxoethyl]thio]-3-(2-fluorophenyl)-5-methyl-6-oxo-4-pyrimidinolate IUPAC Name: 2-[2-(2,4-dimethylanilino)-2-oxoethyl]sulfanyl-3-(2-fluorophenyl)-5-methyl-6-oxopyrimidin-4-olate Traditional Name: 2-[[2-(2,4-dimethylanilino)-2-keto-ethyl]thio]-3-(2-fluorophenyl)-6-keto-5-methyl-pyrimidin-4-olate Formula: C21H19FN3O3S- MolecularWeight: 412.457263

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CSC2=NC(=O)C(=C(N2C3=CC=CC=C3F)[O-])C)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CSC2=NC(=O)C(=C(N2C3=CC=CC=C3F)[O-])C)C

InChI

InChI=1S/C21H20FN3O3S/c1-12-8-9-16(13(2)10-12)23-18(26)11-29-21-24-19(27)14(3)20(28)25(21)17-7-5-4-6-15(17)22/h4-10,28H,11H2,1-3H3,(H,23,26)/p-1