N-(4-ethylphenyl)-2-[6-(3-methoxyphenyl)pyridazin-3-yl]sulfanyl-ethanamide

Systemtic Name: N-(4-ethylphenyl)-2-[6-(3-methoxyphenyl)pyridazin-3-yl]sulfanyl-ethanamide Openeye Name: N-(4-ethylphenyl)-2-[6-(3-methoxyphenyl)pyridazin-3-yl]sulfanyl-acetamide CAS Name: N-(4-ethylphenyl)-2-[[6-(3-methoxyphenyl)-3-pyridazinyl]thio]acetamide IUPAC Name: N-(4-ethylphenyl)-2-[6-(3-methoxyphenyl)pyridazin-3-yl]sulfanylacetamide Traditional Name: N-(4-ethylphenyl)-2-[[6-(3-methoxyphenyl)pyridazin-3-yl]thio]acetamide Formula: C21H21N3O2S MolecularWeight: 379.47534

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)CSC2=NN=C(C=C2)C3=CC(=CC=C3)OC

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)CSC2=NN=C(C=C2)C3=CC(=CC=C3)OC

InChI

InChI=1S/C21H21N3O2S/c1-3-15-7-9-17(10-8-15)22-20(25)14-27-21-12-11-19(23-24-21)16-5-4-6-18(13-16)26-2/h4-13H,3,14H2,1-2H3,(H,22,25)