7-(5,6-diphenylpyridazin-3-yl)sulfanylheptanoic acid

Systemtic Name: 7-(5,6-diphenylpyridazin-3-yl)sulfanylheptanoic acid Openeye Name: 7-(5,6-diphenylpyridazin-3-yl)sulfanylheptanoic acid CAS Name: 7-[(5,6-diphenyl-3-pyridazinyl)thio]heptanoic acid IUPAC Name: 7-(5,6-diphenylpyridazin-3-yl)sulfanylheptanoic acid Traditional Name: 7-[(5,6-diphenylpyridazin-3-yl)thio]enanthic acid Formula: C23H24N2O2S MolecularWeight: 392.51386

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=NN=C2C3=CC=CC=C3)SCCCCCCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=NN=C2C3=CC=CC=C3)SCCCCCCC(=O)O

InChI

InChI=1S/C23H24N2O2S/c26-22(27)15-9-1-2-10-16-28-21-17-20(18-11-5-3-6-12-18)23(25-24-21)19-13-7-4-8-14-19/h3-8,11-14,17H,1-2,9-10,15-16H2,(H,26,27)