5-[(4-bromanyl-2-fluoranyl-phenyl)methylsulfanyl]-1-(3,4-dimethylphenyl)-1,2,3,4-tetrazole

Systemtic Name: 5-[(4-bromanyl-2-fluoranyl-phenyl)methylsulfanyl]-1-(3,4-dimethylphenyl)-1,2,3,4-tetrazole Openeye Name: 5-[(4-bromo-2-fluoro-phenyl)methylsulfanyl]-1-(3,4-dimethylphenyl)tetrazole CAS Name: 5-[(4-bromo-2-fluorophenyl)methylthio]-1-(3,4-dimethylphenyl)tetrazole IUPAC Name: 5-[(4-bromo-2-fluorophenyl)methylsulfanyl]-1-(3,4-dimethylphenyl)tetrazole Traditional Name: 5-[(4-bromo-2-fluoro-benzyl)thio]-1-(3,4-dimethylphenyl)tetrazole Formula: C16H14BrFN4S MolecularWeight: 393.276563

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=NN=N2)SCC3=C(C=C(C=C3)Br)F)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=NN=N2)SCC3=C(C=C(C=C3)Br)F)C

InChI

InChI=1S/C16H14BrFN4S/c1-10-3-6-14(7-11(10)2)22-16(19-20-21-22)23-9-12-4-5-13(17)8-15(12)18/h3-8H,9H2,1-2H3