N-prop-2-ynyl-3-[4-[[4-(trifluoromethyloxy)phenyl]methyl]piperazin-1-yl]carbonyl-benzenesulfonamide

Systemtic Name: N-prop-2-ynyl-3-[4-[[4-(trifluoromethyloxy)phenyl]methyl]piperazin-1-yl]carbonyl-benzenesulfonamide Openeye Name: N-prop-2-ynyl-3-[4-[[4-(trifluoromethoxy)phenyl]methyl]piperazine-1-carbonyl]benzenesulfonamide CAS Name: 3-[oxo-[4-[[4-(trifluoromethoxy)phenyl]methyl]-1-piperazinyl]methyl]-N-prop-2-ynylbenzenesulfonamide IUPAC Name: N-prop-2-ynyl-3-[4-[[4-(trifluoromethoxy)phenyl]methyl]piperazine-1-carbonyl]benzenesulfonamide Traditional Name: N-propargyl-3-[4-[4-(trifluoromethoxy)benzyl]piperazine-1-carbonyl]benzenesulfonamide Formula: C22H22F3N3O4S MolecularWeight: 481.48799

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Descriptors Computed from Structure

Canonical SMILES:

C#CCNS(=O)(=O)C1=CC=CC(=C1)C(=O)N2CCN(CC2)CC3=CC=C(C=C3)OC(F)(F)F

Isomeric SMILES

C#CCNS(=O)(=O)C1=CC=CC(=C1)C(=O)N2CCN(CC2)CC3=CC=C(C=C3)OC(F)(F)F

InChI

InChI=1S/C22H22F3N3O4S/c1-2-10-26-33(30,31)20-5-3-4-18(15-20)21(29)28-13-11-27(12-14-28)16-17-6-8-19(9-7-17)32-22(23,24)25/h1,3-9,15,26H,10-14,16H2