N-(3,4-dimethylphenyl)-4-[[6-(4-methylphenyl)pyridazin-3-yl]sulfanylmethyl]benzamide

Systemtic Name: N-(3,4-dimethylphenyl)-4-[[6-(4-methylphenyl)pyridazin-3-yl]sulfanylmethyl]benzamide Openeye Name: N-(3,4-dimethylphenyl)-4-[[6-(p-tolyl)pyridazin-3-yl]sulfanylmethyl]benzamide CAS Name: N-(3,4-dimethylphenyl)-4-[[[6-(4-methylphenyl)-3-pyridazinyl]thio]methyl]benzamide IUPAC Name: N-(3,4-dimethylphenyl)-4-[[6-(4-methylphenyl)pyridazin-3-yl]sulfanylmethyl]benzamide Traditional Name: N-(3,4-dimethylphenyl)-4-[[[6-(p-tolyl)pyridazin-3-yl]thio]methyl]benzamide Formula: C27H25N3OS MolecularWeight: 439.5719

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(C=C2)SCC3=CC=C(C=C3)C(=O)NC4=CC(=C(C=C4)C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(C=C2)SCC3=CC=C(C=C3)C(=O)NC4=CC(=C(C=C4)C)C

InChI

InChI=1S/C27H25N3OS/c1-18-4-9-22(10-5-18)25-14-15-26(30-29-25)32-17-21-7-11-23(12-8-21)27(31)28-24-13-6-19(2)20(3)16-24/h4-16H,17H2,1-3H3,(H,28,31)