1-(6-phenylpyridazin-3-yl)sulfanylpropan-2-one

Systemtic Name: 1-(6-phenylpyridazin-3-yl)sulfanylpropan-2-one Openeye Name: 1-(6-phenylpyridazin-3-yl)sulfanylpropan-2-one CAS Name: 1-[(6-phenyl-3-pyridazinyl)thio]-2-propanone IUPAC Name: 1-(6-phenylpyridazin-3-yl)sulfanylpropan-2-one Traditional Name: 1-[(6-phenylpyridazin-3-yl)thio]acetone Formula: C13H12N2OS MolecularWeight: 244.31218

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CSC1=NN=C(C=C1)C2=CC=CC=C2

Isomeric SMILES

CC(=O)CSC1=NN=C(C=C1)C2=CC=CC=C2

InChI

InChI=1S/C13H12N2OS/c1-10(16)9-17-13-8-7-12(14-15-13)11-5-3-2-4-6-11/h2-8H,9H2,1H3