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

Systemtic Name: 4-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]carbonyl-N-prop-2-ynyl-benzenesulfonamide Openeye Name: 4-[4-[(2-fluorophenyl)methyl]piperazine-1-carbonyl]-N-prop-2-ynyl-benzenesulfonamide CAS Name: 4-[[4-[(2-fluorophenyl)methyl]-1-piperazinyl]-oxomethyl]-N-prop-2-ynylbenzenesulfonamide IUPAC Name: 4-[4-[(2-fluorophenyl)methyl]piperazine-1-carbonyl]-N-prop-2-ynylbenzenesulfonamide Traditional Name: 4-[4-(2-fluorobenzyl)piperazine-1-carbonyl]-N-propargyl-benzenesulfonamide Formula: C21H22FN3O3S MolecularWeight: 415.481083

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C#CCNS(=O)(=O)C1=CC=C(C=C1)C(=O)N2CCN(CC2)CC3=CC=CC=C3F

Isomeric SMILES

C#CCNS(=O)(=O)C1=CC=C(C=C1)C(=O)N2CCN(CC2)CC3=CC=CC=C3F

InChI

InChI=1S/C21H22FN3O3S/c1-2-11-23-29(27,28)19-9-7-17(8-10-19)21(26)25-14-12-24(13-15-25)16-18-5-3-4-6-20(18)22/h1,3-10,23H,11-16H2