1-[4-(3-chloranyl-4-fluoranyl-phenyl)sulfonylpiperazin-1-yl]-2-cyclopentylsulfanyl-ethanone

Systemtic Name: 1-[4-(3-chloranyl-4-fluoranyl-phenyl)sulfonylpiperazin-1-yl]-2-cyclopentylsulfanyl-ethanone Openeye Name: 1-[4-(3-chloro-4-fluoro-phenyl)sulfonylpiperazin-1-yl]-2-cyclopentylsulfanyl-ethanone CAS Name: 1-[4-(3-chloro-4-fluorophenyl)sulfonyl-1-piperazinyl]-2-(cyclopentylthio)ethanone IUPAC Name: 1-[4-(3-chloro-4-fluorophenyl)sulfonylpiperazin-1-yl]-2-cyclopentylsulfanylethanone Traditional Name: 1-[4-(3-chloro-4-fluoro-phenyl)sulfonylpiperazino]-2-(cyclopentylthio)ethanone Formula: C17H22ClFN2O3S2 MolecularWeight: 420.949583

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)SCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)F)Cl

Isomeric SMILES

C1CCC(C1)SCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C17H22ClFN2O3S2/c18-15-11-14(5-6-16(15)19)26(23,24)21-9-7-20(8-10-21)17(22)12-25-13-3-1-2-4-13/h5-6,11,13H,1-4,7-10,12H2