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

Systemtic Name: 3-[[6-(4-methoxyphenyl)pyridazin-3-yl]sulfanylmethyl]-N-(4-methylphenyl)benzamide Openeye Name: 3-[[6-(4-methoxyphenyl)pyridazin-3-yl]sulfanylmethyl]-N-(p-tolyl)benzamide CAS Name: 3-[[[6-(4-methoxyphenyl)-3-pyridazinyl]thio]methyl]-N-(4-methylphenyl)benzamide IUPAC Name: 3-[[6-(4-methoxyphenyl)pyridazin-3-yl]sulfanylmethyl]-N-(4-methylphenyl)benzamide Traditional Name: 3-[[[6-(4-methoxyphenyl)pyridazin-3-yl]thio]methyl]-N-(p-tolyl)benzamide Formula: C26H23N3O2S MolecularWeight: 441.54472

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C2=CC(=CC=C2)CSC3=NN=C(C=C3)C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C2=CC(=CC=C2)CSC3=NN=C(C=C3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C26H23N3O2S/c1-18-6-10-22(11-7-18)27-26(30)21-5-3-4-19(16-21)17-32-25-15-14-24(28-29-25)20-8-12-23(31-2)13-9-20/h3-16H,17H2,1-2H3,(H,27,30)