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

Systemtic Name: N-(4-chlorophenyl)-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-(4-chlorophenyl)acetamide CAS Name: N-(4-chlorophenyl)-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-(4-chlorophenyl)acetamide Traditional Name: 2-[(5-benzyl-6-hydroxy-4-keto-1-phenyl-pyrimidin-2-yl)thio]-N-(4-chlorophenyl)acetamide Formula: C25H20ClN3O3S MolecularWeight: 477.9626

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=C(N(C(=NC2=O)SCC(=O)NC3=CC=C(C=C3)Cl)C4=CC=CC=C4)O

Isomeric SMILES

C1=CC=C(C=C1)CC2=C(N(C(=NC2=O)SCC(=O)NC3=CC=C(C=C3)Cl)C4=CC=CC=C4)O

InChI

InChI=1S/C25H20ClN3O3S/c26-18-11-13-19(14-12-18)27-22(30)16-33-25-28-23(31)21(15-17-7-3-1-4-8-17)24(32)29(25)20-9-5-2-6-10-20/h1-14,32H,15-16H2,(H,27,30)