N-[(3-methoxyphenyl)methyl]-2-[6-(2-methylphenyl)pyridazin-3-yl]sulfanyl-ethanamide

Systemtic Name: N-[(3-methoxyphenyl)methyl]-2-[6-(2-methylphenyl)pyridazin-3-yl]sulfanyl-ethanamide Openeye Name: N-[(3-methoxyphenyl)methyl]-2-[6-(o-tolyl)pyridazin-3-yl]sulfanyl-acetamide CAS Name: N-[(3-methoxyphenyl)methyl]-2-[[6-(2-methylphenyl)-3-pyridazinyl]thio]acetamide IUPAC Name: N-[(3-methoxyphenyl)methyl]-2-[6-(2-methylphenyl)pyridazin-3-yl]sulfanylacetamide Traditional Name: N-m-anisyl-2-[[6-(o-tolyl)pyridazin-3-yl]thio]acetamide Formula: C21H21N3O2S MolecularWeight: 379.47534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NN=C(C=C2)SCC(=O)NCC3=CC(=CC=C3)OC

Isomeric SMILES

CC1=CC=CC=C1C2=NN=C(C=C2)SCC(=O)NCC3=CC(=CC=C3)OC

InChI

InChI=1S/C21H21N3O2S/c1-15-6-3-4-9-18(15)19-10-11-21(24-23-19)27-14-20(25)22-13-16-7-5-8-17(12-16)26-2/h3-12H,13-14H2,1-2H3,(H,22,25)