4-[5-[2-(4-bromanylphenoxy)ethylsulfanyl]-1,2,3,4-tetrazol-1-yl]phenol

Systemtic Name: 4-[5-[2-(4-bromanylphenoxy)ethylsulfanyl]-1,2,3,4-tetrazol-1-yl]phenol Openeye Name: 4-[5-[2-(4-bromophenoxy)ethylsulfanyl]tetrazol-1-yl]phenol CAS Name: 4-[5-[2-(4-bromophenoxy)ethylthio]-1-tetrazolyl]phenol IUPAC Name: 4-[5-[2-(4-bromophenoxy)ethylsulfanyl]tetrazol-1-yl]phenol Traditional Name: 4-[5-[2-(4-bromophenoxy)ethylthio]tetrazol-1-yl]phenol Formula: C15H13BrN4O2S MolecularWeight: 393.25832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N2C(=NN=N2)SCCOC3=CC=C(C=C3)Br)O

Isomeric SMILES

C1=CC(=CC=C1N2C(=NN=N2)SCCOC3=CC=C(C=C3)Br)O

InChI

InChI=1S/C15H13BrN4O2S/c16-11-1-7-14(8-2-11)22-9-10-23-15-17-18-19-20(15)12-3-5-13(21)6-4-12/h1-8,21H,9-10H2