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

Systemtic Name: 2-[3-(3-phenyl-1,2,4-oxadiazol-5-yl)propylsulfanyl]-6-propyl-1H-pyrimidin-4-one Openeye Name: 2-[3-(3-phenyl-1,2,4-oxadiazol-5-yl)propylsulfanyl]-6-propyl-1H-pyrimidin-4-one CAS Name: 2-[3-(3-phenyl-1,2,4-oxadiazol-5-yl)propylthio]-6-propyl-1H-pyrimidin-4-one IUPAC Name: 2-[3-(3-phenyl-1,2,4-oxadiazol-5-yl)propylsulfanyl]-6-propyl-1H-pyrimidin-4-one Traditional Name: 2-[3-(3-phenyl-1,2,4-oxadiazol-5-yl)propylthio]-6-propyl-1H-pyrimidin-4-one Formula: C18H20N4O2S MolecularWeight: 356.442

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)SCCCC2=NC(=NO2)C3=CC=CC=C3

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)SCCCC2=NC(=NO2)C3=CC=CC=C3

InChI

InChI=1S/C18H20N4O2S/c1-2-7-14-12-15(23)20-18(19-14)25-11-6-10-16-21-17(22-24-16)13-8-4-3-5-9-13/h3-5,8-9,12H,2,6-7,10-11H2,1H3,(H,19,20,23)