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

Systemtic Name: N-(3-chloranyl-2-methyl-phenyl)-2-(5-ethyl-6-oxidanyl-4-oxidanylidene-1-phenyl-pyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: N-(3-chloro-2-methyl-phenyl)-2-(5-ethyl-6-hydroxy-4-oxo-1-phenyl-pyrimidin-2-yl)sulfanyl-acetamide CAS Name: N-(3-chloro-2-methylphenyl)-2-[(5-ethyl-6-hydroxy-4-oxo-1-phenyl-2-pyrimidinyl)thio]acetamide IUPAC Name: N-(3-chloro-2-methylphenyl)-2-(5-ethyl-6-hydroxy-4-oxo-1-phenylpyrimidin-2-yl)sulfanylacetamide Traditional Name: N-(3-chloro-2-methyl-phenyl)-2-[(5-ethyl-6-hydroxy-4-keto-1-phenyl-pyrimidin-2-yl)thio]acetamide Formula: C21H20ClN3O3S MolecularWeight: 429.9198

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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=CC=C3)O

Isomeric SMILES

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

InChI

InChI=1S/C21H20ClN3O3S/c1-3-15-19(27)24-21(25(20(15)28)14-8-5-4-6-9-14)29-12-18(26)23-17-11-7-10-16(22)13(17)2/h4-11,28H,3,12H2,1-2H3,(H,23,26)