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

Systemtic Name: N-tert-butyl-2-[6-oxidanyl-4-oxidanylidene-1-phenyl-5-(phenylmethyl)pyrimidin-2-yl]sulfanyl-ethanamide Openeye Name: 2-(5-benzyl-6-hydroxy-4-oxo-1-phenyl-pyrimidin-2-yl)sulfanyl-N-tert-butyl-acetamide CAS Name: N-tert-butyl-2-[[6-hydroxy-4-oxo-1-phenyl-5-(phenylmethyl)-2-pyrimidinyl]thio]acetamide IUPAC Name: 2-(5-benzyl-6-hydroxy-4-oxo-1-phenylpyrimidin-2-yl)sulfanyl-N-tert-butylacetamide Traditional Name: 2-[(5-benzyl-6-hydroxy-4-keto-1-phenyl-pyrimidin-2-yl)thio]-N-tert-butyl-acetamide Formula: C23H25N3O3S MolecularWeight: 423.5279

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CSC1=NC(=O)C(=C(N1C2=CC=CC=C2)O)CC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)NC(=O)CSC1=NC(=O)C(=C(N1C2=CC=CC=C2)O)CC3=CC=CC=C3

InChI

InChI=1S/C23H25N3O3S/c1-23(2,3)25-19(27)15-30-22-24-20(28)18(14-16-10-6-4-7-11-16)21(29)26(22)17-12-8-5-9-13-17/h4-13,29H,14-15H2,1-3H3,(H,25,27)