N-(4-ethanoylphenyl)-2-[6-(4-ethoxyphenyl)pyridazin-3-yl]sulfanyl-ethanamide

Systemtic Name: N-(4-ethanoylphenyl)-2-[6-(4-ethoxyphenyl)pyridazin-3-yl]sulfanyl-ethanamide Openeye Name: N-(4-acetylphenyl)-2-[6-(4-ethoxyphenyl)pyridazin-3-yl]sulfanyl-acetamide CAS Name: N-(4-acetylphenyl)-2-[[6-(4-ethoxyphenyl)-3-pyridazinyl]thio]acetamide IUPAC Name: N-(4-acetylphenyl)-2-[6-(4-ethoxyphenyl)pyridazin-3-yl]sulfanylacetamide Traditional Name: N-(4-acetylphenyl)-2-[(6-p-phenetylpyridazin-3-yl)thio]acetamide Formula: C22H21N3O3S MolecularWeight: 407.48544

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NN=C(C=C2)SCC(=O)NC3=CC=C(C=C3)C(=O)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NN=C(C=C2)SCC(=O)NC3=CC=C(C=C3)C(=O)C

InChI

InChI=1S/C22H21N3O3S/c1-3-28-19-10-6-17(7-11-19)20-12-13-22(25-24-20)29-14-21(27)23-18-8-4-16(5-9-18)15(2)26/h4-13H,3,14H2,1-2H3,(H,23,27)