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

Systemtic Name: N-tert-butyl-2-(5-butyl-6-oxidanyl-4-oxidanylidene-1-phenyl-pyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: N-tert-butyl-2-(5-butyl-6-hydroxy-4-oxo-1-phenyl-pyrimidin-2-yl)sulfanyl-acetamide CAS Name: N-tert-butyl-2-[(5-butyl-6-hydroxy-4-oxo-1-phenyl-2-pyrimidinyl)thio]acetamide IUPAC Name: N-tert-butyl-2-(5-butyl-6-hydroxy-4-oxo-1-phenylpyrimidin-2-yl)sulfanylacetamide Traditional Name: N-tert-butyl-2-[(5-butyl-6-hydroxy-4-keto-1-phenyl-pyrimidin-2-yl)thio]acetamide Formula: C20H27N3O3S MolecularWeight: 389.51168

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(N(C(=NC1=O)SCC(=O)NC(C)(C)C)C2=CC=CC=C2)O

Isomeric SMILES

CCCCC1=C(N(C(=NC1=O)SCC(=O)NC(C)(C)C)C2=CC=CC=C2)O

InChI

InChI=1S/C20H27N3O3S/c1-5-6-12-15-17(25)21-19(27-13-16(24)22-20(2,3)4)23(18(15)26)14-10-8-7-9-11-14/h7-11,26H,5-6,12-13H2,1-4H3,(H,22,24)