2-[[2-(4-fluorophenyl)-1,3-oxazol-4-yl]methylsulfanyl]-6-propyl-1H-pyrimidin-4-one

Systemtic Name: 2-[[2-(4-fluorophenyl)-1,3-oxazol-4-yl]methylsulfanyl]-6-propyl-1H-pyrimidin-4-one Openeye Name: 2-[[2-(4-fluorophenyl)oxazol-4-yl]methylsulfanyl]-6-propyl-1H-pyrimidin-4-one CAS Name: 2-[[2-(4-fluorophenyl)-4-oxazolyl]methylthio]-6-propyl-1H-pyrimidin-4-one IUPAC Name: 2-[[2-(4-fluorophenyl)-1,3-oxazol-4-yl]methylsulfanyl]-6-propyl-1H-pyrimidin-4-one Traditional Name: 2-[[2-(4-fluorophenyl)oxazol-4-yl]methylthio]-6-propyl-1H-pyrimidin-4-one Formula: C17H16FN3O2S MolecularWeight: 345.391243

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)SCC2=COC(=N2)C3=CC=C(C=C3)F

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)SCC2=COC(=N2)C3=CC=C(C=C3)F

InChI

InChI=1S/C17H16FN3O2S/c1-2-3-13-8-15(22)21-17(20-13)24-10-14-9-23-16(19-14)11-4-6-12(18)7-5-11/h4-9H,2-3,10H2,1H3,(H,20,21,22)