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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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