N-(3-chloranyl-2-methyl-phenyl)-2-[5-ethyl-1-(4-fluorophenyl)-6-oxidanyl-4-oxidanylidene-pyrimidin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(3-chloranyl-2-methyl-phenyl)-2-[5-ethyl-1-(4-fluorophenyl)-6-oxidanyl-4-oxidanylidene-pyrimidin-2-yl]sulfanyl-ethanamide Openeye Name: N-(3-chloro-2-methyl-phenyl)-2-[5-ethyl-1-(4-fluorophenyl)-6-hydroxy-4-oxo-pyrimidin-2-yl]sulfanyl-acetamide CAS Name: N-(3-chloro-2-methylphenyl)-2-[[5-ethyl-1-(4-fluorophenyl)-6-hydroxy-4-oxo-2-pyrimidinyl]thio]acetamide IUPAC Name: N-(3-chloro-2-methylphenyl)-2-[5-ethyl-1-(4-fluorophenyl)-6-hydroxy-4-oxopyrimidin-2-yl]sulfanylacetamide Traditional Name: N-(3-chloro-2-methyl-phenyl)-2-[[5-ethyl-1-(4-fluorophenyl)-6-hydroxy-4-keto-pyrimidin-2-yl]thio]acetamide Formula: C21H19ClFN3O3S MolecularWeight: 447.910263

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H19ClFN3O3S/c1-3-15-19(28)25-21(26(20(15)29)14-9-7-13(23)8-10-14)30-11-18(27)24-17-6-4-5-16(22)12(17)2/h4-10,29H,3,11H2,1-2H3,(H,24,27)