N-[3-(6-oxidanylidene-3-thiophen-2-yl-pyridazin-1-yl)propyl]-2-(trifluoromethyl)benzenesulfonamide

Systemtic Name: N-[3-(6-oxidanylidene-3-thiophen-2-yl-pyridazin-1-yl)propyl]-2-(trifluoromethyl)benzenesulfonamide Openeye Name: N-[3-[6-oxo-3-(2-thienyl)pyridazin-1-yl]propyl]-2-(trifluoromethyl)benzenesulfonamide CAS Name: N-[3-(6-oxo-3-thiophen-2-yl-1-pyridazinyl)propyl]-2-(trifluoromethyl)benzenesulfonamide IUPAC Name: N-[3-(6-oxo-3-thiophen-2-ylpyridazin-1-yl)propyl]-2-(trifluoromethyl)benzenesulfonamide Traditional Name: N-[3-[6-keto-3-(2-thienyl)pyridazin-1-yl]propyl]-2-(trifluoromethyl)benzenesulfonamide Formula: C18H16F3N3O3S2 MolecularWeight: 443.46315

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(F)(F)F)S(=O)(=O)NCCCN2C(=O)C=CC(=N2)C3=CC=CS3

Isomeric SMILES

C1=CC=C(C(=C1)C(F)(F)F)S(=O)(=O)NCCCN2C(=O)C=CC(=N2)C3=CC=CS3

InChI

InChI=1S/C18H16F3N3O3S2/c19-18(20,21)13-5-1-2-7-16(13)29(26,27)22-10-4-11-24-17(25)9-8-14(23-24)15-6-3-12-28-15/h1-3,5-9,12,22H,4,10-11H2