N-(4-ethynylphenyl)-4-[[2-oxidanylidene-4-(trifluoromethyl)-1H-quinolin-6-yl]methyl]benzenesulfonamide

Systemtic Name: N-(4-ethynylphenyl)-4-[[2-oxidanylidene-4-(trifluoromethyl)-1H-quinolin-6-yl]methyl]benzenesulfonamide Openeye Name: N-(4-ethynylphenyl)-4-[[2-oxo-4-(trifluoromethyl)-1H-quinolin-6-yl]methyl]benzenesulfonamide CAS Name: N-(4-ethynylphenyl)-4-[[2-oxo-4-(trifluoromethyl)-1H-quinolin-6-yl]methyl]benzenesulfonamide IUPAC Name: N-(4-ethynylphenyl)-4-[[2-oxo-4-(trifluoromethyl)-1H-quinolin-6-yl]methyl]benzenesulfonamide Traditional Name: N-(4-ethynylphenyl)-4-[[2-keto-4-(trifluoromethyl)-1H-quinolin-6-yl]methyl]benzenesulfonamide Formula: C25H17F3N2O3S MolecularWeight: 482.47429

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)CC3=CC4=C(C=C3)NC(=O)C=C4C(F)(F)F

Isomeric SMILES

C#CC1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)CC3=CC4=C(C=C3)NC(=O)C=C4C(F)(F)F

InChI

InChI=1S/C25H17F3N2O3S/c1-2-16-3-8-19(9-4-16)30-34(32,33)20-10-5-17(6-11-20)13-18-7-12-23-21(14-18)22(25(26,27)28)15-24(31)29-23/h1,3-12,14-15,30H,13H2,(H,29,31)