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

Systemtic Name: N-(4-ethoxyphenyl)-4-[3-(4-fluorophenyl)sulfanyl-6-oxidanylidene-pyridazin-1-yl]benzamide Openeye Name: N-(4-ethoxyphenyl)-4-[3-(4-fluorophenyl)sulfanyl-6-oxo-pyridazin-1-yl]benzamide CAS Name: N-(4-ethoxyphenyl)-4-[3-[(4-fluorophenyl)thio]-6-oxo-1-pyridazinyl]benzamide IUPAC Name: N-(4-ethoxyphenyl)-4-[3-(4-fluorophenyl)sulfanyl-6-oxopyridazin-1-yl]benzamide Traditional Name: 4-[3-[(4-fluorophenyl)thio]-6-keto-pyridazin-1-yl]-N-p-phenetyl-benzamide Formula: C25H20FN3O3S MolecularWeight: 461.508003

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)N3C(=O)C=CC(=N3)SC4=CC=C(C=C4)F

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)N3C(=O)C=CC(=N3)SC4=CC=C(C=C4)F

InChI

InChI=1S/C25H20FN3O3S/c1-2-32-21-11-7-19(8-12-21)27-25(31)17-3-9-20(10-4-17)29-24(30)16-15-23(28-29)33-22-13-5-18(26)6-14-22/h3-16H,2H2,1H3,(H,27,31)