2-fluoranyl-N-[4-methylsulfanyl-1-oxidanylidene-1-(4-piperidin-1-ylcarbonylpiperazin-1-yl)butan-2-yl]benzenesulfonamide

Systemtic Name: 2-fluoranyl-N-[4-methylsulfanyl-1-oxidanylidene-1-(4-piperidin-1-ylcarbonylpiperazin-1-yl)butan-2-yl]benzenesulfonamide Openeye Name: 2-fluoro-N-[3-methylsulfanyl-1-[4-(piperidine-1-carbonyl)piperazine-1-carbonyl]propyl]benzenesulfonamide CAS Name: 2-fluoro-N-[4-(methylthio)-1-oxo-1-[4-[oxo(1-piperidinyl)methyl]-1-piperazinyl]butan-2-yl]benzenesulfonamide IUPAC Name: 2-fluoro-N-[4-methylsulfanyl-1-oxo-1-[4-(piperidine-1-carbonyl)piperazin-1-yl]butan-2-yl]benzenesulfonamide Traditional Name: 2-fluoro-N-[3-(methylthio)-1-[4-(piperidine-1-carbonyl)piperazine-1-carbonyl]propyl]benzenesulfonamide Formula: C21H31FN4O4S2 MolecularWeight: 486.623643

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)N1CCN(CC1)C(=O)N2CCCCC2)NS(=O)(=O)C3=CC=CC=C3F

Isomeric SMILES

CSCCC(C(=O)N1CCN(CC1)C(=O)N2CCCCC2)NS(=O)(=O)C3=CC=CC=C3F

InChI

InChI=1S/C21H31FN4O4S2/c1-31-16-9-18(23-32(29,30)19-8-4-3-7-17(19)22)20(27)24-12-14-26(15-13-24)21(28)25-10-5-2-6-11-25/h3-4,7-8,18,23H,2,5-6,9-16H2,1H3