N-[(3-methoxyphenyl)methyl]-2-[6-(2,4,5-trimethylphenyl)pyridazin-3-yl]sulfanyl-ethanamide

Systemtic Name: N-[(3-methoxyphenyl)methyl]-2-[6-(2,4,5-trimethylphenyl)pyridazin-3-yl]sulfanyl-ethanamide Openeye Name: N-[(3-methoxyphenyl)methyl]-2-[6-(2,4,5-trimethylphenyl)pyridazin-3-yl]sulfanyl-acetamide CAS Name: N-[(3-methoxyphenyl)methyl]-2-[[6-(2,4,5-trimethylphenyl)-3-pyridazinyl]thio]acetamide IUPAC Name: N-[(3-methoxyphenyl)methyl]-2-[6-(2,4,5-trimethylphenyl)pyridazin-3-yl]sulfanylacetamide Traditional Name: N-m-anisyl-2-[[6-(2,4,5-trimethylphenyl)pyridazin-3-yl]thio]acetamide Formula: C23H25N3O2S MolecularWeight: 407.5285

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C2=NN=C(C=C2)SCC(=O)NCC3=CC(=CC=C3)OC)C)C

Isomeric SMILES

CC1=CC(=C(C=C1C2=NN=C(C=C2)SCC(=O)NCC3=CC(=CC=C3)OC)C)C

InChI

InChI=1S/C23H25N3O2S/c1-15-10-17(3)20(11-16(15)2)21-8-9-23(26-25-21)29-14-22(27)24-13-18-6-5-7-19(12-18)28-4/h5-12H,13-14H2,1-4H3,(H,24,27)