2,5-bis(fluoranyl)-N-[2-(4-methylpiperazin-1-yl)-2-thiophen-3-yl-ethyl]benzenesulfonamide

Systemtic Name: 2,5-bis(fluoranyl)-N-[2-(4-methylpiperazin-1-yl)-2-thiophen-3-yl-ethyl]benzenesulfonamide Openeye Name: 2,5-difluoro-N-[2-(4-methylpiperazin-1-yl)-2-(3-thienyl)ethyl]benzenesulfonamide CAS Name: 2,5-difluoro-N-[2-(4-methyl-1-piperazinyl)-2-(3-thiophenyl)ethyl]benzenesulfonamide IUPAC Name: 2,5-difluoro-N-[2-(4-methylpiperazin-1-yl)-2-thiophen-3-ylethyl]benzenesulfonamide Traditional Name: 2,5-difluoro-N-[2-(4-methylpiperazino)-2-(3-thienyl)ethyl]benzenesulfonamide Formula: C17H21F2N3O2S2 MolecularWeight: 401.494346

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(CNS(=O)(=O)C2=C(C=CC(=C2)F)F)C3=CSC=C3

Isomeric SMILES

CN1CCN(CC1)C(CNS(=O)(=O)C2=C(C=CC(=C2)F)F)C3=CSC=C3

InChI

InChI=1S/C17H21F2N3O2S2/c1-21-5-7-22(8-6-21)16(13-4-9-25-12-13)11-20-26(23,24)17-10-14(18)2-3-15(17)19/h2-4,9-10,12,16,20H,5-8,11H2,1H3