5-[(2Z)-3,7-dimethylocta-2,6-dienyl]sulfanyl-1-phenyl-1,2,3,4-tetrazole

Systemtic Name: 5-[(2Z)-3,7-dimethylocta-2,6-dienyl]sulfanyl-1-phenyl-1,2,3,4-tetrazole Openeye Name: 5-[(2Z)-3,7-dimethylocta-2,6-dienyl]sulfanyl-1-phenyl-tetrazole CAS Name: 5-[[(2Z)-3,7-dimethylocta-2,6-dienyl]thio]-1-phenyltetrazole IUPAC Name: 5-[(2Z)-3,7-dimethylocta-2,6-dienyl]sulfanyl-1-phenyltetrazole Traditional Name: 5-[[(2Z)-3,7-dimethylocta-2,6-dienyl]thio]-1-phenyl-tetrazole Formula: C17H22N4S MolecularWeight: 314.44838

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCC(=CCSC1=NN=NN1C2=CC=CC=C2)C)C

Isomeric SMILES

CC(=CCC/C(=C\CSC1=NN=NN1C2=CC=CC=C2)/C)C

InChI

InChI=1S/C17H22N4S/c1-14(2)8-7-9-15(3)12-13-22-17-18-19-20-21(17)16-10-5-4-6-11-16/h4-6,8,10-12H,7,9,13H2,1-3H3/b15-12-