(10E)-7-fluoranyl-N,N-dimethyl-10-[3-(4-methylpiperazin-1-yl)propylidene]phenoxathiine-2-sulfonamide

Systemtic Name: (10E)-7-fluoranyl-N,N-dimethyl-10-[3-(4-methylpiperazin-1-yl)propylidene]phenoxathiine-2-sulfonamide Openeye Name: (10E)-7-fluoro-N,N-dimethyl-10-[3-(4-methylpiperazin-1-yl)propylidene]phenoxathiine-2-sulfonamide CAS Name: (10E)-7-fluoro-N,N-dimethyl-10-[3-(4-methyl-1-piperazinyl)propylidene]-2-phenoxathiinesulfonamide IUPAC Name: (10E)-7-fluoro-N,N-dimethyl-10-[3-(4-methylpiperazin-1-yl)propylidene]phenoxathiine-2-sulfonamide Traditional Name: (10E)-7-fluoro-N,N-dimethyl-10-[3-(4-methylpiperazino)propylidene]phenoxathiine-2-sulfonamide Formula: C22H28FN3O3S2 MolecularWeight: 465.604423

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCC=S2C3=C(C=C(C=C3)F)OC4=C2C=C(C=C4)S(=O)(=O)N(C)C

Isomeric SMILES

CN1CCN(CC1)CC/C=S/2\C3=C(C=C(C=C3)F)OC4=C2C=C(C=C4)S(=O)(=O)N(C)C

InChI

InChI=1S/C22H28FN3O3S2/c1-24(2)31(27,28)18-6-7-19-22(16-18)30(21-8-5-17(23)15-20(21)29-19)14-4-9-26-12-10-25(3)11-13-26/h5-8,14-16H,4,9-13H2,1-3H3