2-[6-(3,4-dimethoxyphenyl)pyridazin-3-yl]sulfanyl-1-(4-methylphenyl)ethanone

Systemtic Name: 2-[6-(3,4-dimethoxyphenyl)pyridazin-3-yl]sulfanyl-1-(4-methylphenyl)ethanone Openeye Name: 2-[6-(3,4-dimethoxyphenyl)pyridazin-3-yl]sulfanyl-1-(p-tolyl)ethanone CAS Name: 2-[[6-(3,4-dimethoxyphenyl)-3-pyridazinyl]thio]-1-(4-methylphenyl)ethanone IUPAC Name: 2-[6-(3,4-dimethoxyphenyl)pyridazin-3-yl]sulfanyl-1-(4-methylphenyl)ethanone Traditional Name: 2-[[6-(3,4-dimethoxyphenyl)pyridazin-3-yl]thio]-1-(p-tolyl)ethanone Formula: C21H20N2O3S MolecularWeight: 380.4601

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)CSC2=NN=C(C=C2)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)CSC2=NN=C(C=C2)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C21H20N2O3S/c1-14-4-6-15(7-5-14)18(24)13-27-21-11-9-17(22-23-21)16-8-10-19(25-2)20(12-16)26-3/h4-12H,13H2,1-3H3