3-[(2,4-dimethylphenyl)sulfanylmethyl]-5-(4-fluorophenyl)-1,2,4-oxadiazole

Systemtic Name: 3-[(2,4-dimethylphenyl)sulfanylmethyl]-5-(4-fluorophenyl)-1,2,4-oxadiazole Openeye Name: 3-[(2,4-dimethylphenyl)sulfanylmethyl]-5-(4-fluorophenyl)-1,2,4-oxadiazole CAS Name: 3-[[(2,4-dimethylphenyl)thio]methyl]-5-(4-fluorophenyl)-1,2,4-oxadiazole IUPAC Name: 3-[(2,4-dimethylphenyl)sulfanylmethyl]-5-(4-fluorophenyl)-1,2,4-oxadiazole Traditional Name: 3-[[(2,4-dimethylphenyl)thio]methyl]-5-(4-fluorophenyl)-1,2,4-oxadiazole Formula: C17H15FN2OS MolecularWeight: 314.377203

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)SCC2=NOC(=N2)C3=CC=C(C=C3)F)C

Isomeric SMILES

CC1=CC(=C(C=C1)SCC2=NOC(=N2)C3=CC=C(C=C3)F)C

InChI

InChI=1S/C17H15FN2OS/c1-11-3-8-15(12(2)9-11)22-10-16-19-17(21-20-16)13-4-6-14(18)7-5-13/h3-9H,10H2,1-2H3