2-[[4,6-bis(fluoranyl)-1,3-benzothiazol-2-yl]-ethanoyl-amino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[4,6-bis(fluoranyl)-1,3-benzothiazol-2-yl]-ethanoyl-amino]ethyl-dimethyl-azanium Openeye Name: 2-[acetyl-(4,6-difluoro-1,3-benzothiazol-2-yl)amino]ethyl-dimethyl-ammonium CAS Name: 2-[acetyl-(4,6-difluoro-1,3-benzothiazol-2-yl)amino]ethyl-dimethylammonium IUPAC Name: 2-[acetyl-(4,6-difluoro-1,3-benzothiazol-2-yl)amino]ethyl-dimethylazanium Traditional Name: 2-[acetyl-(4,6-difluoro-1,3-benzothiazol-2-yl)amino]ethyl-dimethyl-ammonium Formula: C13H16F2N3OS+ MolecularWeight: 300.347446

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(CC[NH+](C)C)C1=NC2=C(C=C(C=C2S1)F)F

Isomeric SMILES

CC(=O)N(CC[NH+](C)C)C1=NC2=C(C=C(C=C2S1)F)F

InChI

InChI=1S/C13H15F2N3OS/c1-8(19)18(5-4-17(2)3)13-16-12-10(15)6-9(14)7-11(12)20-13/h6-7H,4-5H2,1-3H3/p+1