N-(2,6-dimethylphenyl)-4-[3-(4-fluorophenyl)sulfanyl-6-oxidanylidene-pyridazin-1-yl]benzamide

Systemtic Name: N-(2,6-dimethylphenyl)-4-[3-(4-fluorophenyl)sulfanyl-6-oxidanylidene-pyridazin-1-yl]benzamide Openeye Name: N-(2,6-dimethylphenyl)-4-[3-(4-fluorophenyl)sulfanyl-6-oxo-pyridazin-1-yl]benzamide CAS Name: N-(2,6-dimethylphenyl)-4-[3-[(4-fluorophenyl)thio]-6-oxo-1-pyridazinyl]benzamide IUPAC Name: N-(2,6-dimethylphenyl)-4-[3-(4-fluorophenyl)sulfanyl-6-oxopyridazin-1-yl]benzamide Traditional Name: N-(2,6-dimethylphenyl)-4-[3-[(4-fluorophenyl)thio]-6-keto-pyridazin-1-yl]benzamide Formula: C25H20FN3O2S MolecularWeight: 445.508603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)C2=CC=C(C=C2)N3C(=O)C=CC(=N3)SC4=CC=C(C=C4)F

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)C2=CC=C(C=C2)N3C(=O)C=CC(=N3)SC4=CC=C(C=C4)F

InChI

InChI=1S/C25H20FN3O2S/c1-16-4-3-5-17(2)24(16)27-25(31)18-6-10-20(11-7-18)29-23(30)15-14-22(28-29)32-21-12-8-19(26)9-13-21/h3-15H,1-2H3,(H,27,31)