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

Systemtic Name: 3-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]carbonyl-N-prop-2-ynyl-benzenesulfonamide Openeye Name: 3-[4-[(2-fluorophenyl)methyl]piperazine-1-carbonyl]-N-prop-2-ynyl-benzenesulfonamide CAS Name: 3-[[4-[(2-fluorophenyl)methyl]-1-piperazinyl]-oxomethyl]-N-prop-2-ynylbenzenesulfonamide IUPAC Name: 3-[4-[(2-fluorophenyl)methyl]piperazine-1-carbonyl]-N-prop-2-ynylbenzenesulfonamide Traditional Name: 3-[4-(2-fluorobenzyl)piperazine-1-carbonyl]-N-propargyl-benzenesulfonamide Formula: C21H22FN3O3S MolecularWeight: 415.481083

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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