2-[(3-chloranyl-2-fluoranyl-phenyl)amino]-1-(4-methylsulfonylpiperazin-1-yl)ethanone

Systemtic Name: 2-[(3-chloranyl-2-fluoranyl-phenyl)amino]-1-(4-methylsulfonylpiperazin-1-yl)ethanone Openeye Name: 2-(3-chloro-2-fluoro-anilino)-1-(4-methylsulfonylpiperazin-1-yl)ethanone CAS Name: 2-(3-chloro-2-fluoroanilino)-1-(4-methylsulfonyl-1-piperazinyl)ethanone IUPAC Name: 2-(3-chloro-2-fluoroanilino)-1-(4-methylsulfonylpiperazin-1-yl)ethanone Traditional Name: 2-(3-chloro-2-fluoro-anilino)-1-(4-mesylpiperazino)ethanone Formula: C13H17ClFN3O3S MolecularWeight: 349.808783

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCN(CC1)C(=O)CNC2=C(C(=CC=C2)Cl)F

Isomeric SMILES

CS(=O)(=O)N1CCN(CC1)C(=O)CNC2=C(C(=CC=C2)Cl)F

InChI

InChI=1S/C13H17ClFN3O3S/c1-22(20,21)18-7-5-17(6-8-18)12(19)9-16-11-4-2-3-10(14)13(11)15/h2-4,16H,5-9H2,1H3