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

Systemtic Name: 2-[[5-(5-methyl-3-phenyl-1,2-oxazol-4-yl)-1,3,4-oxadiazol-2-yl]methylsulfanyl]-6-propyl-1H-pyrimidin-4-one Openeye Name: 2-[[5-(5-methyl-3-phenyl-isoxazol-4-yl)-1,3,4-oxadiazol-2-yl]methylsulfanyl]-6-propyl-1H-pyrimidin-4-one CAS Name: 2-[[5-(5-methyl-3-phenyl-4-isoxazolyl)-1,3,4-oxadiazol-2-yl]methylthio]-6-propyl-1H-pyrimidin-4-one IUPAC Name: 2-[[5-(5-methyl-3-phenyl-1,2-oxazol-4-yl)-1,3,4-oxadiazol-2-yl]methylsulfanyl]-6-propyl-1H-pyrimidin-4-one Traditional Name: 2-[[5-(5-methyl-3-phenyl-isoxazol-4-yl)-1,3,4-oxadiazol-2-yl]methylthio]-6-propyl-1H-pyrimidin-4-one Formula: C20H19N5O3S MolecularWeight: 409.46156

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)SCC2=NN=C(O2)C3=C(ON=C3C4=CC=CC=C4)C

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)SCC2=NN=C(O2)C3=C(ON=C3C4=CC=CC=C4)C

InChI

InChI=1S/C20H19N5O3S/c1-3-7-14-10-15(26)22-20(21-14)29-11-16-23-24-19(27-16)17-12(2)28-25-18(17)13-8-5-4-6-9-13/h4-6,8-10H,3,7,11H2,1-2H3,(H,21,22,26)