3-[1,3-benzothiazol-2-yl-[2,6-bis(fluoranyl)phenyl]carbonyl-amino]propyl-dimethyl-azanium

Systemtic Name: 3-[1,3-benzothiazol-2-yl-[2,6-bis(fluoranyl)phenyl]carbonyl-amino]propyl-dimethyl-azanium Openeye Name: 3-[1,3-benzothiazol-2-yl-(2,6-difluorobenzoyl)amino]propyl-dimethyl-ammonium CAS Name: 3-[1,3-benzothiazol-2-yl-[(2,6-difluorophenyl)-oxomethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[1,3-benzothiazol-2-yl-(2,6-difluorobenzoyl)amino]propyl-dimethylazanium Traditional Name: 3-[1,3-benzothiazol-2-yl-(2,6-difluorobenzoyl)amino]propyl-dimethyl-ammonium Formula: C19H20F2N3OS+ MolecularWeight: 376.443406

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCN(C1=NC2=CC=CC=C2S1)C(=O)C3=C(C=CC=C3F)F

Isomeric SMILES

C[NH+](C)CCCN(C1=NC2=CC=CC=C2S1)C(=O)C3=C(C=CC=C3F)F

InChI

InChI=1S/C19H19F2N3OS/c1-23(2)11-6-12-24(18(25)17-13(20)7-5-8-14(17)21)19-22-15-9-3-4-10-16(15)26-19/h3-5,7-10H,6,11-12H2,1-2H3/p+1