5-[(4-bromophenyl)methylsulfanyl]-1-(furan-2-ylmethyl)-1,2,3,4-tetrazole

Systemtic Name: 5-[(4-bromophenyl)methylsulfanyl]-1-(furan-2-ylmethyl)-1,2,3,4-tetrazole Openeye Name: 5-[(4-bromophenyl)methylsulfanyl]-1-(2-furylmethyl)tetrazole CAS Name: 5-[(4-bromophenyl)methylthio]-1-(2-furanylmethyl)tetrazole IUPAC Name: 5-[(4-bromophenyl)methylsulfanyl]-1-(furan-2-ylmethyl)tetrazole Traditional Name: 5-[(4-bromobenzyl)thio]-1-(2-furfuryl)tetrazole Formula: C13H11BrN4OS MolecularWeight: 351.22164

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CN2C(=NN=N2)SCC3=CC=C(C=C3)Br

Isomeric SMILES

C1=COC(=C1)CN2C(=NN=N2)SCC3=CC=C(C=C3)Br

InChI

InChI=1S/C13H11BrN4OS/c14-11-5-3-10(4-6-11)9-20-13-15-16-17-18(13)8-12-2-1-7-19-12/h1-7H,8-9H2