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

Systemtic Name: 2-[(6-fluoranyl-1,3-benzothiazol-2-yl)-(4-methylsulfanylphenyl)carbonyl-amino]ethyl-dimethyl-azanium Openeye Name: 2-[(6-fluoro-1,3-benzothiazol-2-yl)-(4-methylsulfanylbenzoyl)amino]ethyl-dimethyl-ammonium CAS Name: 2-[(6-fluoro-1,3-benzothiazol-2-yl)-[[4-(methylthio)phenyl]-oxomethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[(6-fluoro-1,3-benzothiazol-2-yl)-(4-methylsulfanylbenzoyl)amino]ethyl-dimethylazanium Traditional Name: 2-[(6-fluoro-1,3-benzothiazol-2-yl)-[4-(methylthio)benzoyl]amino]ethyl-dimethyl-ammonium Formula: C19H21FN3OS2+ MolecularWeight: 390.517943

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCN(C1=NC2=C(S1)C=C(C=C2)F)C(=O)C3=CC=C(C=C3)SC

Isomeric SMILES

C[NH+](C)CCN(C1=NC2=C(S1)C=C(C=C2)F)C(=O)C3=CC=C(C=C3)SC

InChI

InChI=1S/C19H20FN3OS2/c1-22(2)10-11-23(18(24)13-4-7-15(25-3)8-5-13)19-21-16-9-6-14(20)12-17(16)26-19/h4-9,12H,10-11H2,1-3H3/p+1