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

Systemtic Name: 1-[5-[(4-bromanyl-2-fluoranyl-phenyl)methylsulfanyl]-1,3,4-oxadiazol-2-yl]-2-phenyl-ethanamine Openeye Name: 1-[5-[(4-bromo-2-fluoro-phenyl)methylsulfanyl]-1,3,4-oxadiazol-2-yl]-2-phenyl-ethanamine CAS Name: 1-[5-[(4-bromo-2-fluorophenyl)methylthio]-1,3,4-oxadiazol-2-yl]-2-phenylethanamine IUPAC Name: 1-[5-[(4-bromo-2-fluorophenyl)methylsulfanyl]-1,3,4-oxadiazol-2-yl]-2-phenylethanamine Traditional Name: [1-[5-[(4-bromo-2-fluoro-benzyl)thio]-1,3,4-oxadiazol-2-yl]-2-phenyl-ethyl]amine Formula: C17H15BrFN3OS MolecularWeight: 408.287903

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C2=NN=C(O2)SCC3=C(C=C(C=C3)Br)F)N

Isomeric SMILES

C1=CC=C(C=C1)CC(C2=NN=C(O2)SCC3=C(C=C(C=C3)Br)F)N

InChI

InChI=1S/C17H15BrFN3OS/c18-13-7-6-12(14(19)9-13)10-24-17-22-21-16(23-17)15(20)8-11-4-2-1-3-5-11/h1-7,9,15H,8,10,20H2