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

Systemtic Name: N-(2,6-dimethylphenyl)-2-(5-ethyl-6-oxidanyl-4-oxidanylidene-1-phenyl-pyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: N-(2,6-dimethylphenyl)-2-(5-ethyl-6-hydroxy-4-oxo-1-phenyl-pyrimidin-2-yl)sulfanyl-acetamide CAS Name: N-(2,6-dimethylphenyl)-2-[(5-ethyl-6-hydroxy-4-oxo-1-phenyl-2-pyrimidinyl)thio]acetamide IUPAC Name: N-(2,6-dimethylphenyl)-2-(5-ethyl-6-hydroxy-4-oxo-1-phenylpyrimidin-2-yl)sulfanylacetamide Traditional Name: N-(2,6-dimethylphenyl)-2-[(5-ethyl-6-hydroxy-4-keto-1-phenyl-pyrimidin-2-yl)thio]acetamide Formula: C22H23N3O3S MolecularWeight: 409.50132

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N(C(=NC1=O)SCC(=O)NC2=C(C=CC=C2C)C)C3=CC=CC=C3)O

Isomeric SMILES

CCC1=C(N(C(=NC1=O)SCC(=O)NC2=C(C=CC=C2C)C)C3=CC=CC=C3)O

InChI

InChI=1S/C22H23N3O3S/c1-4-17-20(27)24-22(25(21(17)28)16-11-6-5-7-12-16)29-13-18(26)23-19-14(2)9-8-10-15(19)3/h5-12,28H,4,13H2,1-3H3,(H,23,26)