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

Systemtic Name: N-(3-acetamidophenyl)-2-[6-(2,5-dimethoxyphenyl)pyridazin-3-yl]sulfanyl-ethanamide Openeye Name: N-(3-acetamidophenyl)-2-[6-(2,5-dimethoxyphenyl)pyridazin-3-yl]sulfanyl-acetamide CAS Name: N-(3-acetamidophenyl)-2-[[6-(2,5-dimethoxyphenyl)-3-pyridazinyl]thio]acetamide IUPAC Name: N-(3-acetamidophenyl)-2-[6-(2,5-dimethoxyphenyl)pyridazin-3-yl]sulfanylacetamide Traditional Name: N-(3-acetamidophenyl)-2-[[6-(2,5-dimethoxyphenyl)pyridazin-3-yl]thio]acetamide Formula: C22H22N4O4S MolecularWeight: 438.49948

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=CC=C1)NC(=O)CSC2=NN=C(C=C2)C3=C(C=CC(=C3)OC)OC

Isomeric SMILES

CC(=O)NC1=CC(=CC=C1)NC(=O)CSC2=NN=C(C=C2)C3=C(C=CC(=C3)OC)OC

InChI

InChI=1S/C22H22N4O4S/c1-14(27)23-15-5-4-6-16(11-15)24-21(28)13-31-22-10-8-19(25-26-22)18-12-17(29-2)7-9-20(18)30-3/h4-12H,13H2,1-3H3,(H,23,27)(H,24,28)