2-[[3-(3-fluoranyl-4-methyl-phenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-1,3-benzoxazole

Systemtic Name: 2-[[3-(3-fluoranyl-4-methyl-phenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-1,3-benzoxazole Openeye Name: 2-[[3-(3-fluoro-4-methyl-phenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-1,3-benzoxazole CAS Name: 2-[[3-(3-fluoro-4-methylphenyl)-1,2,4-oxadiazol-5-yl]methylthio]-1,3-benzoxazole IUPAC Name: 2-[[3-(3-fluoro-4-methylphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-1,3-benzoxazole Traditional Name: 2-[[3-(3-fluoro-4-methyl-phenyl)-1,2,4-oxadiazol-5-yl]methylthio]-1,3-benzoxazole Formula: C17H12FN3O2S MolecularWeight: 341.359483

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NOC(=N2)CSC3=NC4=CC=CC=C4O3)F

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NOC(=N2)CSC3=NC4=CC=CC=C4O3)F

InChI

InChI=1S/C17H12FN3O2S/c1-10-6-7-11(8-12(10)18)16-20-15(23-21-16)9-24-17-19-13-4-2-3-5-14(13)22-17/h2-8H,9H2,1H3