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

Systemtic Name: N-(3-acetamidophenyl)-2-[6-(4-methoxyphenyl)pyridazin-3-yl]sulfanyl-ethanamide Openeye Name: N-(3-acetamidophenyl)-2-[6-(4-methoxyphenyl)pyridazin-3-yl]sulfanyl-acetamide CAS Name: N-(3-acetamidophenyl)-2-[[6-(4-methoxyphenyl)-3-pyridazinyl]thio]acetamide IUPAC Name: N-(3-acetamidophenyl)-2-[6-(4-methoxyphenyl)pyridazin-3-yl]sulfanylacetamide Traditional Name: N-(3-acetamidophenyl)-2-[[6-(4-methoxyphenyl)pyridazin-3-yl]thio]acetamide Formula: C21H20N4O3S MolecularWeight: 408.4735

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20N4O3S/c1-14(26)22-16-4-3-5-17(12-16)23-20(27)13-29-21-11-10-19(24-25-21)15-6-8-18(28-2)9-7-15/h3-12H,13H2,1-2H3,(H,22,26)(H,23,27)