5-[3-[(2-butyl-4-fluoranyl-3-iodanyl-phenyl)methylsulfanyl]propylsulfanyl]-2H-1,2,3,4-tetrazole

Systemtic Name: 5-[3-[(2-butyl-4-fluoranyl-3-iodanyl-phenyl)methylsulfanyl]propylsulfanyl]-2H-1,2,3,4-tetrazole Openeye Name: 5-[3-[(2-butyl-4-fluoro-3-iodo-phenyl)methylsulfanyl]propylsulfanyl]-2H-tetrazole CAS Name: 5-[3-[(2-butyl-4-fluoro-3-iodophenyl)methylthio]propylthio]-2H-tetrazole IUPAC Name: 5-[3-[(2-butyl-4-fluoro-3-iodophenyl)methylsulfanyl]propylsulfanyl]-2H-tetrazole Traditional Name: 5-[3-[(2-butyl-4-fluoro-3-iodo-benzyl)thio]propylthio]-2H-tetrazole Formula: C15H20FIN4S2 MolecularWeight: 466.378973

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=CC(=C1I)F)CSCCCSC2=NNN=N2

Isomeric SMILES

CCCCC1=C(C=CC(=C1I)F)CSCCCSC2=NNN=N2

InChI

InChI=1S/C15H20FIN4S2/c1-2-3-5-12-11(6-7-13(16)14(12)17)10-22-8-4-9-23-15-18-20-21-19-15/h6-7H,2-5,8-10H2,1H3,(H,18,19,20,21)