3-fluoranyl-1-[5-methyl-2-(methylsulfanylsulfonylamino)phenyl]piperazine

Systemtic Name: 3-fluoranyl-1-[5-methyl-2-(methylsulfanylsulfonylamino)phenyl]piperazine Openeye Name: 3-fluoro-1-[5-methyl-2-(methylsulfanylsulfonylamino)phenyl]piperazine CAS Name: 3-fluoro-1-[5-methyl-2-[(methylthio)sulfonylamino]phenyl]piperazine IUPAC Name: 3-fluoro-1-[5-methyl-2-(methylsulfanylsulfonylamino)phenyl]piperazine Traditional Name: 3-fluoro-1-[5-methyl-2-[(methylthio)sulfonylamino]phenyl]piperazine Formula: C12H18FN3O2S2 MolecularWeight: 319.418623

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NS(=O)(=O)SC)N2CCNC(C2)F

Isomeric SMILES

CC1=CC(=C(C=C1)NS(=O)(=O)SC)N2CCNC(C2)F

InChI

InChI=1S/C12H18FN3O2S2/c1-9-3-4-10(15-20(17,18)19-2)11(7-9)16-6-5-14-12(13)8-16/h3-4,7,12,14-15H,5-6,8H2,1-2H3