N-(2,5-dimethoxyphenyl)-2-[6-(4-methylphenyl)pyridazin-3-yl]sulfanyl-ethanamide

Systemtic Name: N-(2,5-dimethoxyphenyl)-2-[6-(4-methylphenyl)pyridazin-3-yl]sulfanyl-ethanamide Openeye Name: N-(2,5-dimethoxyphenyl)-2-[6-(p-tolyl)pyridazin-3-yl]sulfanyl-acetamide CAS Name: N-(2,5-dimethoxyphenyl)-2-[[6-(4-methylphenyl)-3-pyridazinyl]thio]acetamide IUPAC Name: N-(2,5-dimethoxyphenyl)-2-[6-(4-methylphenyl)pyridazin-3-yl]sulfanylacetamide Traditional Name: N-(2,5-dimethoxyphenyl)-2-[[6-(p-tolyl)pyridazin-3-yl]thio]acetamide Formula: C21H21N3O3S MolecularWeight: 395.47474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(C=C2)SCC(=O)NC3=C(C=CC(=C3)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(C=C2)SCC(=O)NC3=C(C=CC(=C3)OC)OC

InChI

InChI=1S/C21H21N3O3S/c1-14-4-6-15(7-5-14)17-9-11-21(24-23-17)28-13-20(25)22-18-12-16(26-2)8-10-19(18)27-3/h4-12H,13H2,1-3H3,(H,22,25)