N-(3-methylbutan-2-yl)-3-[[6-(4-methylphenyl)pyridazin-3-yl]sulfanylmethyl]benzamide

Systemtic Name: N-(3-methylbutan-2-yl)-3-[[6-(4-methylphenyl)pyridazin-3-yl]sulfanylmethyl]benzamide Openeye Name: N-(1,2-dimethylpropyl)-3-[[6-(p-tolyl)pyridazin-3-yl]sulfanylmethyl]benzamide CAS Name: N-(3-methylbutan-2-yl)-3-[[[6-(4-methylphenyl)-3-pyridazinyl]thio]methyl]benzamide IUPAC Name: N-(3-methylbutan-2-yl)-3-[[6-(4-methylphenyl)pyridazin-3-yl]sulfanylmethyl]benzamide Traditional Name: N-(1,2-dimethylpropyl)-3-[[[6-(p-tolyl)pyridazin-3-yl]thio]methyl]benzamide Formula: C24H27N3OS MolecularWeight: 405.55568

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H27N3OS/c1-16(2)18(4)25-24(28)21-7-5-6-19(14-21)15-29-23-13-12-22(26-27-23)20-10-8-17(3)9-11-20/h5-14,16,18H,15H2,1-4H3,(H,25,28)