N-(2,5-dimethoxyphenyl)-4-[3-(4-fluorophenyl)sulfanyl-6-oxidanylidene-pyridazin-1-yl]benzamide

Systemtic Name: N-(2,5-dimethoxyphenyl)-4-[3-(4-fluorophenyl)sulfanyl-6-oxidanylidene-pyridazin-1-yl]benzamide Openeye Name: N-(2,5-dimethoxyphenyl)-4-[3-(4-fluorophenyl)sulfanyl-6-oxo-pyridazin-1-yl]benzamide CAS Name: N-(2,5-dimethoxyphenyl)-4-[3-[(4-fluorophenyl)thio]-6-oxo-1-pyridazinyl]benzamide IUPAC Name: N-(2,5-dimethoxyphenyl)-4-[3-(4-fluorophenyl)sulfanyl-6-oxopyridazin-1-yl]benzamide Traditional Name: N-(2,5-dimethoxyphenyl)-4-[3-[(4-fluorophenyl)thio]-6-keto-pyridazin-1-yl]benzamide Formula: C25H20FN3O4S MolecularWeight: 477.507403

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)NC(=O)C2=CC=C(C=C2)N3C(=O)C=CC(=N3)SC4=CC=C(C=C4)F

Isomeric SMILES

COC1=CC(=C(C=C1)OC)NC(=O)C2=CC=C(C=C2)N3C(=O)C=CC(=N3)SC4=CC=C(C=C4)F

InChI

InChI=1S/C25H20FN3O4S/c1-32-19-9-12-22(33-2)21(15-19)27-25(31)16-3-7-18(8-4-16)29-24(30)14-13-23(28-29)34-20-10-5-17(26)6-11-20/h3-15H,1-2H3,(H,27,31)