N-(4-ethoxyphenyl)-2-[[5-(4-fluoranyl-3-methyl-phenyl)sulfonyl-6-oxidanylidene-1H-pyrimidin-2-yl]sulfanyl]ethanamide

Systemtic Name: N-(4-ethoxyphenyl)-2-[[5-(4-fluoranyl-3-methyl-phenyl)sulfonyl-6-oxidanylidene-1H-pyrimidin-2-yl]sulfanyl]ethanamide Openeye Name: N-(4-ethoxyphenyl)-2-[[5-(4-fluoro-3-methyl-phenyl)sulfonyl-6-oxo-1H-pyrimidin-2-yl]sulfanyl]acetamide CAS Name: N-(4-ethoxyphenyl)-2-[[5-(4-fluoro-3-methylphenyl)sulfonyl-6-oxo-1H-pyrimidin-2-yl]thio]acetamide IUPAC Name: N-(4-ethoxyphenyl)-2-[[5-(4-fluoro-3-methylphenyl)sulfonyl-6-oxo-1H-pyrimidin-2-yl]sulfanyl]acetamide Traditional Name: 2-[[5-(4-fluoro-3-methyl-phenyl)sulfonyl-6-keto-1H-pyrimidin-2-yl]thio]-N-p-phenetyl-acetamide Formula: C21H20FN3O5S2 MolecularWeight: 477.529003

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)CSC2=NC=C(C(=O)N2)S(=O)(=O)C3=CC(=C(C=C3)F)C

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)CSC2=NC=C(C(=O)N2)S(=O)(=O)C3=CC(=C(C=C3)F)C

InChI

InChI=1S/C21H20FN3O5S2/c1-3-30-15-6-4-14(5-7-15)24-19(26)12-31-21-23-11-18(20(27)25-21)32(28,29)16-8-9-17(22)13(2)10-16/h4-11H,3,12H2,1-2H3,(H,24,26)(H,23,25,27)