4-azanyl-3-[[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-6-methyl-1,2,4-triazin-5-one

Systemtic Name: 4-azanyl-3-[[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-6-methyl-1,2,4-triazin-5-one Openeye Name: 4-amino-3-[[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-6-methyl-1,2,4-triazin-5-one CAS Name: 4-amino-3-[[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methylthio]-6-methyl-1,2,4-triazin-5-one IUPAC Name: 4-amino-3-[[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-6-methyl-1,2,4-triazin-5-one Traditional Name: 4-amino-3-[[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methylthio]-6-methyl-1,2,4-triazin-5-one Formula: C13H11FN6O2S MolecularWeight: 334.328843

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N(C1=O)N)SCC2=NC(=NO2)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=NN=C(N(C1=O)N)SCC2=NC(=NO2)C3=CC=C(C=C3)F

InChI

InChI=1S/C13H11FN6O2S/c1-7-12(21)20(15)13(18-17-7)23-6-10-16-11(19-22-10)8-2-4-9(14)5-3-8/h2-5H,6,15H2,1H3