N-(2,5-dimethylphenyl)-2-[6-(2-methoxyphenyl)pyridazin-3-yl]sulfanyl-ethanamide

Systemtic Name: N-(2,5-dimethylphenyl)-2-[6-(2-methoxyphenyl)pyridazin-3-yl]sulfanyl-ethanamide Openeye Name: N-(2,5-dimethylphenyl)-2-[6-(2-methoxyphenyl)pyridazin-3-yl]sulfanyl-acetamide CAS Name: N-(2,5-dimethylphenyl)-2-[[6-(2-methoxyphenyl)-3-pyridazinyl]thio]acetamide IUPAC Name: N-(2,5-dimethylphenyl)-2-[6-(2-methoxyphenyl)pyridazin-3-yl]sulfanylacetamide Traditional Name: N-(2,5-dimethylphenyl)-2-[[6-(2-methoxyphenyl)pyridazin-3-yl]thio]acetamide Formula: C21H21N3O2S MolecularWeight: 379.47534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)CSC2=NN=C(C=C2)C3=CC=CC=C3OC

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)CSC2=NN=C(C=C2)C3=CC=CC=C3OC

InChI

InChI=1S/C21H21N3O2S/c1-14-8-9-15(2)18(12-14)22-20(25)13-27-21-11-10-17(23-24-21)16-6-4-5-7-19(16)26-3/h4-12H,13H2,1-3H3,(H,22,25)