N-(3-chloranyl-4-methyl-phenyl)-2-[6-(3,4-dimethylphenyl)pyridazin-3-yl]sulfanyl-ethanamide

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-2-[6-(3,4-dimethylphenyl)pyridazin-3-yl]sulfanyl-ethanamide Openeye Name: N-(3-chloro-4-methyl-phenyl)-2-[6-(3,4-dimethylphenyl)pyridazin-3-yl]sulfanyl-acetamide CAS Name: N-(3-chloro-4-methylphenyl)-2-[[6-(3,4-dimethylphenyl)-3-pyridazinyl]thio]acetamide IUPAC Name: N-(3-chloro-4-methylphenyl)-2-[6-(3,4-dimethylphenyl)pyridazin-3-yl]sulfanylacetamide Traditional Name: N-(3-chloro-4-methyl-phenyl)-2-[[6-(3,4-dimethylphenyl)pyridazin-3-yl]thio]acetamide Formula: C21H20ClN3OS MolecularWeight: 397.921

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN=C(C=C2)SCC(=O)NC3=CC(=C(C=C3)C)Cl)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN=C(C=C2)SCC(=O)NC3=CC(=C(C=C3)C)Cl)C

InChI

InChI=1S/C21H20ClN3OS/c1-13-4-6-16(10-15(13)3)19-8-9-21(25-24-19)27-12-20(26)23-17-7-5-14(2)18(22)11-17/h4-11H,12H2,1-3H3,(H,23,26)