N-(3-chloranyl-2-methyl-phenyl)-2-[6-(4-ethoxyphenyl)pyridazin-3-yl]sulfanyl-ethanamide

Systemtic Name: N-(3-chloranyl-2-methyl-phenyl)-2-[6-(4-ethoxyphenyl)pyridazin-3-yl]sulfanyl-ethanamide Openeye Name: N-(3-chloro-2-methyl-phenyl)-2-[6-(4-ethoxyphenyl)pyridazin-3-yl]sulfanyl-acetamide CAS Name: N-(3-chloro-2-methylphenyl)-2-[[6-(4-ethoxyphenyl)-3-pyridazinyl]thio]acetamide IUPAC Name: N-(3-chloro-2-methylphenyl)-2-[6-(4-ethoxyphenyl)pyridazin-3-yl]sulfanylacetamide Traditional Name: N-(3-chloro-2-methyl-phenyl)-2-[(6-p-phenetylpyridazin-3-yl)thio]acetamide Formula: C21H20ClN3O2S MolecularWeight: 413.9204

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20ClN3O2S/c1-3-27-16-9-7-15(8-10-16)19-11-12-21(25-24-19)28-13-20(26)23-18-6-4-5-17(22)14(18)2/h4-12H,3,13H2,1-2H3,(H,23,26)