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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NOC(=N2)CSC3=NC(=O)C(=C(N3)C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NOC(=N2)CSC3=NC(=O)C(=C(N3)C)C

InChI

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