N-[[6-(4-cyclopentylpiperazin-1-yl)pyridin-3-yl]methyl]-3-fluoranyl-benzenesulfonamide

Systemtic Name: N-[[6-(4-cyclopentylpiperazin-1-yl)pyridin-3-yl]methyl]-3-fluoranyl-benzenesulfonamide Openeye Name: N-[[6-(4-cyclopentylpiperazin-1-yl)-3-pyridyl]methyl]-3-fluoro-benzenesulfonamide CAS Name: N-[[6-(4-cyclopentyl-1-piperazinyl)-3-pyridinyl]methyl]-3-fluorobenzenesulfonamide IUPAC Name: N-[[6-(4-cyclopentylpiperazin-1-yl)pyridin-3-yl]methyl]-3-fluorobenzenesulfonamide Traditional Name: N-[[6-(4-cyclopentylpiperazino)-3-pyridyl]methyl]-3-fluoro-benzenesulfonamide Formula: C21H27FN4O2S MolecularWeight: 418.528083

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2CCN(CC2)C3=NC=C(C=C3)CNS(=O)(=O)C4=CC=CC(=C4)F

Isomeric SMILES

C1CCC(C1)N2CCN(CC2)C3=NC=C(C=C3)CNS(=O)(=O)C4=CC=CC(=C4)F

InChI

InChI=1S/C21H27FN4O2S/c22-18-4-3-7-20(14-18)29(27,28)24-16-17-8-9-21(23-15-17)26-12-10-25(11-13-26)19-5-1-2-6-19/h3-4,7-9,14-15,19,24H,1-2,5-6,10-13,16H2