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

Systemtic Name: N-(3-chloranyl-2-methyl-phenyl)-2-[6-(2,5-dimethylphenyl)pyridazin-3-yl]sulfanyl-ethanamide Openeye Name: N-(3-chloro-2-methyl-phenyl)-2-[6-(2,5-dimethylphenyl)pyridazin-3-yl]sulfanyl-acetamide CAS Name: N-(3-chloro-2-methylphenyl)-2-[[6-(2,5-dimethylphenyl)-3-pyridazinyl]thio]acetamide IUPAC Name: N-(3-chloro-2-methylphenyl)-2-[6-(2,5-dimethylphenyl)pyridazin-3-yl]sulfanylacetamide Traditional Name: N-(3-chloro-2-methyl-phenyl)-2-[[6-(2,5-dimethylphenyl)pyridazin-3-yl]thio]acetamide Formula: C21H20ClN3OS MolecularWeight: 397.921

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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