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9-(5,6-diphenylpyridazin-3-yl)sulfanylnonanoic acid

9-(5,6-diphenylpyridazin-3-yl)sulfanylnonanoic acid

Systemtic Name:9-(5,6-diphenylpyridazin-3-yl)sulfanylnonanoic acid
Openeye Name:9-(5,6-diphenylpyridazin-3-yl)sulfanylnonanoic acid
CAS Name:9-[(5,6-diphenyl-3-pyridazinyl)thio]nonanoic acid
IUPAC Name:9-(5,6-diphenylpyridazin-3-yl)sulfanylnonanoic acid
Traditional Name:9-[(5,6-diphenylpyridazin-3-yl)thio]pelargonic acid
Formula: C25H28N2O2S
MolecularWeight: 420.56702
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C25H28N2O2S/c28-24(29)17-11-3-1-2-4-12-18-30-23-19-22(20-13-7-5-8-14-20)25(27-26-23)21-15-9-6-10-16-21/h5-10,13-16,19H,1-4,11-12,17-18H2,(H,28,29)


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