N-(3-fluoranyl-4-methyl-phenyl)-2-[6-(3-nitrophenyl)pyridazin-3-yl]sulfanyl-ethanamide

Systemtic Name: N-(3-fluoranyl-4-methyl-phenyl)-2-[6-(3-nitrophenyl)pyridazin-3-yl]sulfanyl-ethanamide Openeye Name: N-(3-fluoro-4-methyl-phenyl)-2-[6-(3-nitrophenyl)pyridazin-3-yl]sulfanyl-acetamide CAS Name: N-(3-fluoro-4-methylphenyl)-2-[[6-(3-nitrophenyl)-3-pyridazinyl]thio]acetamide IUPAC Name: N-(3-fluoro-4-methylphenyl)-2-[6-(3-nitrophenyl)pyridazin-3-yl]sulfanylacetamide Traditional Name: N-(3-fluoro-4-methyl-phenyl)-2-[[6-(3-nitrophenyl)pyridazin-3-yl]thio]acetamide Formula: C19H15FN4O3S MolecularWeight: 398.410803

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CSC2=NN=C(C=C2)C3=CC(=CC=C3)[N+](=O)[O-])F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CSC2=NN=C(C=C2)C3=CC(=CC=C3)[N+](=O)[O-])F

InChI

InChI=1S/C19H15FN4O3S/c1-12-5-6-14(10-16(12)20)21-18(25)11-28-19-8-7-17(22-23-19)13-3-2-4-15(9-13)24(26)27/h2-10H,11H2,1H3,(H,21,25)