2-[4-oxidanylidene-2-(1-phenylethylsulfanyl)-1H-pyrimidin-6-yl]-N-phenethyl-ethanamide

Systemtic Name: 2-[4-oxidanylidene-2-(1-phenylethylsulfanyl)-1H-pyrimidin-6-yl]-N-phenethyl-ethanamide Openeye Name: 2-[4-oxo-2-(1-phenylethylsulfanyl)-1H-pyrimidin-6-yl]-N-phenethyl-acetamide CAS Name: 2-[4-oxo-2-(1-phenylethylthio)-1H-pyrimidin-6-yl]-N-phenethylacetamide IUPAC Name: 2-[4-oxo-2-(1-phenylethylsulfanyl)-1H-pyrimidin-6-yl]-N-phenethylacetamide Traditional Name: 2-[4-keto-2-(1-phenylethylthio)-1H-pyrimidin-6-yl]-N-phenethyl-acetamide Formula: C22H23N3O2S MolecularWeight: 393.50192

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)SC2=NC(=O)C=C(N2)CC(=O)NCCC3=CC=CC=C3

Isomeric SMILES

CC(C1=CC=CC=C1)SC2=NC(=O)C=C(N2)CC(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C22H23N3O2S/c1-16(18-10-6-3-7-11-18)28-22-24-19(15-21(27)25-22)14-20(26)23-13-12-17-8-4-2-5-9-17/h2-11,15-16H,12-14H2,1H3,(H,23,26)(H,24,25,27)