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

Systemtic Name: 4-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]carbonyl-N-propan-2-yl-benzenesulfonamide Openeye Name: 4-[4-[(2-fluorophenyl)methyl]piperazine-1-carbonyl]-N-isopropyl-benzenesulfonamide CAS Name: 4-[[4-[(2-fluorophenyl)methyl]-1-piperazinyl]-oxomethyl]-N-propan-2-ylbenzenesulfonamide IUPAC Name: 4-[4-[(2-fluorophenyl)methyl]piperazine-1-carbonyl]-N-propan-2-ylbenzenesulfonamide Traditional Name: 4-[4-(2-fluorobenzyl)piperazine-1-carbonyl]-N-isopropyl-benzenesulfonamide Formula: C21H26FN3O3S MolecularWeight: 419.512843

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NS(=O)(=O)C1=CC=C(C=C1)C(=O)N2CCN(CC2)CC3=CC=CC=C3F

Isomeric SMILES

CC(C)NS(=O)(=O)C1=CC=C(C=C1)C(=O)N2CCN(CC2)CC3=CC=CC=C3F

InChI

InChI=1S/C21H26FN3O3S/c1-16(2)23-29(27,28)19-9-7-17(8-10-19)21(26)25-13-11-24(12-14-25)15-18-5-3-4-6-20(18)22/h3-10,16,23H,11-15H2,1-2H3