3-(1,3-benzothiazol-2-yl)-N-(4-fluorophenyl)-1-methyl-3-oxidanidyl-imidazolidin-3-ium-4-amine

Systemtic Name: 3-(1,3-benzothiazol-2-yl)-N-(4-fluorophenyl)-1-methyl-3-oxidanidyl-imidazolidin-3-ium-4-amine Openeye Name: 3-(1,3-benzothiazol-2-yl)-N-(4-fluorophenyl)-1-methyl-3-oxido-imidazolidin-3-ium-4-amine CAS Name: 3-(1,3-benzothiazol-2-yl)-N-(4-fluorophenyl)-1-methyl-3-oxido-4-imidazolidin-3-iumamine IUPAC Name: 3-(1,3-benzothiazol-2-yl)-N-(4-fluorophenyl)-1-methyl-3-oxidoimidazolidin-3-ium-4-amine Traditional Name: [3-(1,3-benzothiazol-2-yl)-1-methyl-3-oxido-imidazolidin-3-ium-4-yl]-(4-fluorophenyl)amine Formula: C17H17FN4OS MolecularWeight: 344.406483

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC([N+](C1)(C2=NC3=CC=CC=C3S2)[O-])NC4=CC=C(C=C4)F

Isomeric SMILES

CN1CC([N+](C1)(C2=NC3=CC=CC=C3S2)[O-])NC4=CC=C(C=C4)F

InChI

InChI=1S/C17H17FN4OS/c1-21-10-16(19-13-8-6-12(18)7-9-13)22(23,11-21)17-20-14-4-2-3-5-15(14)24-17/h2-9,16,19H,10-11H2,1H3