N-(4-ethoxyphenyl)-2-[5-ethyl-1-(4-fluorophenyl)-6-oxidanyl-4-oxidanylidene-pyrimidin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(4-ethoxyphenyl)-2-[5-ethyl-1-(4-fluorophenyl)-6-oxidanyl-4-oxidanylidene-pyrimidin-2-yl]sulfanyl-ethanamide Openeye Name: N-(4-ethoxyphenyl)-2-[5-ethyl-1-(4-fluorophenyl)-6-hydroxy-4-oxo-pyrimidin-2-yl]sulfanyl-acetamide CAS Name: N-(4-ethoxyphenyl)-2-[[5-ethyl-1-(4-fluorophenyl)-6-hydroxy-4-oxo-2-pyrimidinyl]thio]acetamide IUPAC Name: N-(4-ethoxyphenyl)-2-[5-ethyl-1-(4-fluorophenyl)-6-hydroxy-4-oxopyrimidin-2-yl]sulfanylacetamide Traditional Name: 2-[[5-ethyl-1-(4-fluorophenyl)-6-hydroxy-4-keto-pyrimidin-2-yl]thio]-N-p-phenetyl-acetamide Formula: C22H22FN3O4S MolecularWeight: 443.491183

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N(C(=NC1=O)SCC(=O)NC2=CC=C(C=C2)OCC)C3=CC=C(C=C3)F)O

Isomeric SMILES

CCC1=C(N(C(=NC1=O)SCC(=O)NC2=CC=C(C=C2)OCC)C3=CC=C(C=C3)F)O

InChI

InChI=1S/C22H22FN3O4S/c1-3-18-20(28)25-22(26(21(18)29)16-9-5-14(23)6-10-16)31-13-19(27)24-15-7-11-17(12-8-15)30-4-2/h5-12,29H,3-4,13H2,1-2H3,(H,24,27)