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

Systemtic Name: 4-fluoranyl-2-(4-methylpiperazin-4-ium-1-yl)-1,3-benzothiazole Openeye Name: 4-fluoro-2-(4-methylpiperazin-4-ium-1-yl)-1,3-benzothiazole CAS Name: 4-fluoro-2-(4-methyl-1-piperazin-4-iumyl)-1,3-benzothiazole IUPAC Name: 4-fluoro-2-(4-methylpiperazin-4-ium-1-yl)-1,3-benzothiazole Traditional Name: 4-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(C=CC=C3S2)F

Isomeric SMILES

C[NH+]1CCN(CC1)C2=NC3=C(C=CC=C3S2)F

InChI

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