6-fluoranyl-2-(4-methylpiperazin-4-ium-1-yl)-1,3-benzothiazole

Systemtic Name: 6-fluoranyl-2-(4-methylpiperazin-4-ium-1-yl)-1,3-benzothiazole Openeye Name: 6-fluoro-2-(4-methylpiperazin-4-ium-1-yl)-1,3-benzothiazole CAS Name: 6-fluoro-2-(4-methyl-1-piperazin-4-iumyl)-1,3-benzothiazole IUPAC Name: 6-fluoro-2-(4-methylpiperazin-4-ium-1-yl)-1,3-benzothiazole Traditional Name: 6-fluoro-2-(4-methylpiperazin-4-ium-1-yl)-1,3-benzothiazole Formula: C12H15FN3S+ MolecularWeight: 252.331003

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=NC3=C(S2)C=C(C=C3)F

Isomeric SMILES

C[NH+]1CCN(CC1)C2=NC3=C(S2)C=C(C=C3)F

InChI

InChI=1S/C12H14FN3S/c1-15-4-6-16(7-5-15)12-14-10-3-2-9(13)8-11(10)17-12/h2-3,8H,4-7H2,1H3/p+1