2-[6-oxidanylidene-4-phenyl-2-(phenylmethylsulfanyl)pyrimidin-1-yl]-N-phenyl-ethanamide

Systemtic Name: 2-[6-oxidanylidene-4-phenyl-2-(phenylmethylsulfanyl)pyrimidin-1-yl]-N-phenyl-ethanamide Openeye Name: 2-(2-benzylsulfanyl-6-oxo-4-phenyl-pyrimidin-1-yl)-N-phenyl-acetamide CAS Name: 2-[6-oxo-4-phenyl-2-(phenylmethylthio)-1-pyrimidinyl]-N-phenylacetamide IUPAC Name: 2-(2-benzylsulfanyl-6-oxo-4-phenylpyrimidin-1-yl)-N-phenylacetamide Traditional Name: 2-[2-(benzylthio)-6-keto-4-phenyl-pyrimidin-1-yl]-N-phenyl-acetamide Formula: C25H21N3O2S MolecularWeight: 427.51814

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NC(=CC(=O)N2CC(=O)NC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NC(=CC(=O)N2CC(=O)NC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H21N3O2S/c29-23(26-21-14-8-3-9-15-21)17-28-24(30)16-22(20-12-6-2-7-13-20)27-25(28)31-18-19-10-4-1-5-11-19/h1-16H,17-18H2,(H,26,29)