N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(6-thiophen-2-ylpyridazin-3-yl)sulfanyl-ethanamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(6-thiophen-2-ylpyridazin-3-yl)sulfanyl-ethanamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[6-(2-thienyl)pyridazin-3-yl]sulfanyl-acetamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(6-thiophen-2-yl-3-pyridazinyl)thio]acetamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(6-thiophen-2-ylpyridazin-3-yl)sulfanylacetamide Traditional Name: N-homoveratryl-2-[[6-(2-thienyl)pyridazin-3-yl]thio]acetamide Formula: C20H21N3O3S2 MolecularWeight: 415.52904

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)CSC2=NN=C(C=C2)C3=CC=CS3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)CSC2=NN=C(C=C2)C3=CC=CS3)OC

InChI

InChI=1S/C20H21N3O3S2/c1-25-16-7-5-14(12-17(16)26-2)9-10-21-19(24)13-28-20-8-6-15(22-23-20)18-4-3-11-27-18/h3-8,11-12H,9-10,13H2,1-2H3,(H,21,24)