2-[2-[(3,5-dimethoxyphenyl)methylsulfanyl]-4-oxidanylidene-1H-pyrimidin-6-yl]-N-phenethyl-ethanamide

Systemtic Name: 2-[2-[(3,5-dimethoxyphenyl)methylsulfanyl]-4-oxidanylidene-1H-pyrimidin-6-yl]-N-phenethyl-ethanamide Openeye Name: 2-[2-[(3,5-dimethoxyphenyl)methylsulfanyl]-4-oxo-1H-pyrimidin-6-yl]-N-phenethyl-acetamide CAS Name: 2-[2-[(3,5-dimethoxyphenyl)methylthio]-4-oxo-1H-pyrimidin-6-yl]-N-phenethylacetamide IUPAC Name: 2-[2-[(3,5-dimethoxyphenyl)methylsulfanyl]-4-oxo-1H-pyrimidin-6-yl]-N-phenethylacetamide Traditional Name: 2-[2-[(3,5-dimethoxybenzyl)thio]-4-keto-1H-pyrimidin-6-yl]-N-phenethyl-acetamide Formula: C23H25N3O4S MolecularWeight: 439.5273

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)CSC2=NC(=O)C=C(N2)CC(=O)NCCC3=CC=CC=C3)OC

Isomeric SMILES

COC1=CC(=CC(=C1)CSC2=NC(=O)C=C(N2)CC(=O)NCCC3=CC=CC=C3)OC

InChI

InChI=1S/C23H25N3O4S/c1-29-19-10-17(11-20(14-19)30-2)15-31-23-25-18(13-22(28)26-23)12-21(27)24-9-8-16-6-4-3-5-7-16/h3-7,10-11,13-14H,8-9,12,15H2,1-2H3,(H,24,27)(H,25,26,28)