2-(4-methyl-6-oxidanylidene-2-phenethylsulfanyl-pyrimidin-1-yl)-N-phenyl-ethanamide

Systemtic Name: 2-(4-methyl-6-oxidanylidene-2-phenethylsulfanyl-pyrimidin-1-yl)-N-phenyl-ethanamide Openeye Name: 2-(4-methyl-6-oxo-2-phenethylsulfanyl-pyrimidin-1-yl)-N-phenyl-acetamide CAS Name: 2-[4-methyl-6-oxo-2-(phenethylthio)-1-pyrimidinyl]-N-phenylacetamide IUPAC Name: 2-(4-methyl-6-oxo-2-phenethylsulfanylpyrimidin-1-yl)-N-phenylacetamide Traditional Name: 2-[6-keto-4-methyl-2-(phenethylthio)pyrimidin-1-yl]-N-phenyl-acetamide Formula: C21H21N3O2S MolecularWeight: 379.47534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(C(=N1)SCCC2=CC=CC=C2)CC(=O)NC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=O)N(C(=N1)SCCC2=CC=CC=C2)CC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C21H21N3O2S/c1-16-14-20(26)24(15-19(25)23-18-10-6-3-7-11-18)21(22-16)27-13-12-17-8-4-2-5-9-17/h2-11,14H,12-13,15H2,1H3,(H,23,25)