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

Systemtic Name: N-(4-ethoxyphenyl)-2-(5-ethyl-6-oxidanyl-4-oxidanylidene-1-phenyl-pyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: N-(4-ethoxyphenyl)-2-(5-ethyl-6-hydroxy-4-oxo-1-phenyl-pyrimidin-2-yl)sulfanyl-acetamide CAS Name: N-(4-ethoxyphenyl)-2-[(5-ethyl-6-hydroxy-4-oxo-1-phenyl-2-pyrimidinyl)thio]acetamide IUPAC Name: N-(4-ethoxyphenyl)-2-(5-ethyl-6-hydroxy-4-oxo-1-phenylpyrimidin-2-yl)sulfanylacetamide Traditional Name: 2-[(5-ethyl-6-hydroxy-4-keto-1-phenyl-pyrimidin-2-yl)thio]-N-p-phenetyl-acetamide Formula: C22H23N3O4S MolecularWeight: 425.50072

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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=CC=C3)O

Isomeric SMILES

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

InChI

InChI=1S/C22H23N3O4S/c1-3-18-20(27)24-22(25(21(18)28)16-8-6-5-7-9-16)30-14-19(26)23-15-10-12-17(13-11-15)29-4-2/h5-13,28H,3-4,14H2,1-2H3,(H,23,26)