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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)SCC2=NC(=NO2)CC3=CC=CC=C3

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)SCC2=NC(=NO2)CC3=CC=CC=C3

InChI

InChI=1S/C17H18N4O2S/c1-2-6-13-10-15(22)20-17(18-13)24-11-16-19-14(21-23-16)9-12-7-4-3-5-8-12/h3-5,7-8,10H,2,6,9,11H2,1H3,(H,18,20,22)