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

Systemtic Name: 2-[(3-phenyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]-6-propan-2-yl-1H-pyrimidin-4-one Openeye Name: 6-isopropyl-2-[(3-phenyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]-1H-pyrimidin-4-one CAS Name: 2-[(3-phenyl-1,2,4-oxadiazol-5-yl)methylthio]-6-propan-2-yl-1H-pyrimidin-4-one IUPAC Name: 2-[(3-phenyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]-6-propan-2-yl-1H-pyrimidin-4-one Traditional Name: 6-isopropyl-2-[(3-phenyl-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:

CC(C)C1=CC(=O)N=C(N1)SCC2=NC(=NO2)C3=CC=CC=C3

Isomeric SMILES

CC(C)C1=CC(=O)N=C(N1)SCC2=NC(=NO2)C3=CC=CC=C3

InChI

InChI=1S/C16H16N4O2S/c1-10(2)12-8-13(21)18-16(17-12)23-9-14-19-15(20-22-14)11-6-4-3-5-7-11/h3-8,10H,9H2,1-2H3,(H,17,18,21)