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

Systemtic Name: 2-[2-[(4-ethoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-3-(4-fluorophenyl)-5-methyl-6-oxidanylidene-pyrimidin-4-olate Openeye Name: 2-[2-(4-ethoxyanilino)-2-oxo-ethyl]sulfanyl-3-(4-fluorophenyl)-5-methyl-6-oxo-pyrimidin-4-olate CAS Name: 2-[[2-(4-ethoxyanilino)-2-oxoethyl]thio]-3-(4-fluorophenyl)-5-methyl-6-oxo-4-pyrimidinolate IUPAC Name: 2-[2-(4-ethoxyanilino)-2-oxoethyl]sulfanyl-3-(4-fluorophenyl)-5-methyl-6-oxopyrimidin-4-olate Traditional Name: 3-(4-fluorophenyl)-6-keto-2-[[2-keto-2-(p-phenetidino)ethyl]thio]-5-methyl-pyrimidin-4-olate Formula: C21H19FN3O4S- MolecularWeight: 428.456663

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)CSC2=NC(=O)C(=C(N2C3=CC=C(C=C3)F)[O-])C

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)CSC2=NC(=O)C(=C(N2C3=CC=C(C=C3)F)[O-])C

InChI

InChI=1S/C21H20FN3O4S/c1-3-29-17-10-6-15(7-11-17)23-18(26)12-30-21-24-19(27)13(2)20(28)25(21)16-8-4-14(22)5-9-16/h4-11,28H,3,12H2,1-2H3,(H,23,26)/p-1