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

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(6-phenylpyridazin-3-yl)sulfanyl-ethanamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(6-phenylpyridazin-3-yl)sulfanyl-acetamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(6-phenyl-3-pyridazinyl)thio]acetamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(6-phenylpyridazin-3-yl)sulfanylacetamide Traditional Name: N-homoveratryl-2-[(6-phenylpyridazin-3-yl)thio]acetamide Formula: C22H23N3O3S MolecularWeight: 409.50132

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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=CC=C3)OC

Isomeric SMILES

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

InChI

InChI=1S/C22H23N3O3S/c1-27-19-10-8-16(14-20(19)28-2)12-13-23-21(26)15-29-22-11-9-18(24-25-22)17-6-4-3-5-7-17/h3-11,14H,12-13,15H2,1-2H3,(H,23,26)