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

Systemtic Name: N-prop-2-ynyl-4-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]carbonyl-benzenesulfonamide Openeye Name: N-prop-2-ynyl-4-[4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl]benzenesulfonamide CAS Name: 4-[oxo-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]methyl]-N-prop-2-ynylbenzenesulfonamide IUPAC Name: N-prop-2-ynyl-4-[4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl]benzenesulfonamide Traditional Name: N-propargyl-4-[4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl]benzenesulfonamide Formula: C21H20F3N3O3S MolecularWeight: 451.46201

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20F3N3O3S/c1-2-10-25-31(29,30)19-8-6-16(7-9-19)20(28)27-13-11-26(12-14-27)18-5-3-4-17(15-18)21(22,23)24/h1,3-9,15,25H,10-14H2