2-[[4-(3-methyl-1,2,4-oxadiazol-5-yl)phenyl]methylsulfanyl]-6-propyl-1H-pyrimidin-4-one

Systemtic Name: 2-[[4-(3-methyl-1,2,4-oxadiazol-5-yl)phenyl]methylsulfanyl]-6-propyl-1H-pyrimidin-4-one Openeye Name: 2-[[4-(3-methyl-1,2,4-oxadiazol-5-yl)phenyl]methylsulfanyl]-6-propyl-1H-pyrimidin-4-one CAS Name: 2-[[4-(3-methyl-1,2,4-oxadiazol-5-yl)phenyl]methylthio]-6-propyl-1H-pyrimidin-4-one IUPAC Name: 2-[[4-(3-methyl-1,2,4-oxadiazol-5-yl)phenyl]methylsulfanyl]-6-propyl-1H-pyrimidin-4-one Traditional Name: 2-[[4-(3-methyl-1,2,4-oxadiazol-5-yl)benzyl]thio]-6-propyl-1H-pyrimidin-4-one Formula: C17H18N4O2S MolecularWeight: 342.41542

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)SCC2=CC=C(C=C2)C3=NC(=NO3)C

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)SCC2=CC=C(C=C2)C3=NC(=NO3)C

InChI

InChI=1S/C17H18N4O2S/c1-3-4-14-9-15(22)20-17(19-14)24-10-12-5-7-13(8-6-12)16-18-11(2)21-23-16/h5-9H,3-4,10H2,1-2H3,(H,19,20,22)