2-[6-methyl-4-oxidanylidene-2-(1-phenylethylsulfanyl)-1H-pyrimidin-5-yl]-N-phenyl-ethanamide

Systemtic Name: 2-[6-methyl-4-oxidanylidene-2-(1-phenylethylsulfanyl)-1H-pyrimidin-5-yl]-N-phenyl-ethanamide Openeye Name: 2-[6-methyl-4-oxo-2-(1-phenylethylsulfanyl)-1H-pyrimidin-5-yl]-N-phenyl-acetamide CAS Name: 2-[6-methyl-4-oxo-2-(1-phenylethylthio)-1H-pyrimidin-5-yl]-N-phenylacetamide IUPAC Name: 2-[6-methyl-4-oxo-2-(1-phenylethylsulfanyl)-1H-pyrimidin-5-yl]-N-phenylacetamide Traditional Name: 2-[4-keto-6-methyl-2-(1-phenylethylthio)-1H-pyrimidin-5-yl]-N-phenyl-acetamide Formula: C21H21N3O2S MolecularWeight: 379.47534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)SC(C)C2=CC=CC=C2)CC(=O)NC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=O)N=C(N1)SC(C)C2=CC=CC=C2)CC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C21H21N3O2S/c1-14-18(13-19(25)23-17-11-7-4-8-12-17)20(26)24-21(22-14)27-15(2)16-9-5-3-6-10-16/h3-12,15H,13H2,1-2H3,(H,23,25)(H,22,24,26)