6-ethyl-2-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-1H-pyrimidin-4-one

Systemtic Name: 6-ethyl-2-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-1H-pyrimidin-4-one Openeye Name: 6-ethyl-2-[[3-(p-tolyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-1H-pyrimidin-4-one CAS Name: 6-ethyl-2-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methylthio]-1H-pyrimidin-4-one IUPAC Name: 6-ethyl-2-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-1H-pyrimidin-4-one Traditional Name: 6-ethyl-2-[[3-(p-tolyl)-1,2,4-oxadiazol-5-yl]methylthio]-1H-pyrimidin-4-one Formula: C16H16N4O2S MolecularWeight: 328.38884

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=O)N=C(N1)SCC2=NC(=NO2)C3=CC=C(C=C3)C

Isomeric SMILES

CCC1=CC(=O)N=C(N1)SCC2=NC(=NO2)C3=CC=C(C=C3)C

InChI

InChI=1S/C16H16N4O2S/c1-3-12-8-13(21)18-16(17-12)23-9-14-19-15(20-22-14)11-6-4-10(2)5-7-11/h4-8H,3,9H2,1-2H3,(H,17,18,21)