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

Systemtic Name: 3-[[4,6-bis(fluoranyl)-1,3-benzothiazol-2-yl]-cyclohexylcarbonyl-amino]propyl-dimethyl-azanium Openeye Name: 3-[cyclohexanecarbonyl-(4,6-difluoro-1,3-benzothiazol-2-yl)amino]propyl-dimethyl-ammonium CAS Name: 3-[[cyclohexyl(oxo)methyl]-(4,6-difluoro-1,3-benzothiazol-2-yl)amino]propyl-dimethylammonium IUPAC Name: 3-[cyclohexanecarbonyl-(4,6-difluoro-1,3-benzothiazol-2-yl)amino]propyl-dimethylazanium Traditional Name: 3-[cyclohexanecarbonyl-(4,6-difluoro-1,3-benzothiazol-2-yl)amino]propyl-dimethyl-ammonium Formula: C19H26F2N3OS+ MolecularWeight: 382.491046

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCN(C1=NC2=C(C=C(C=C2S1)F)F)C(=O)C3CCCCC3

Isomeric SMILES

C[NH+](C)CCCN(C1=NC2=C(C=C(C=C2S1)F)F)C(=O)C3CCCCC3

InChI

InChI=1S/C19H25F2N3OS/c1-23(2)9-6-10-24(18(25)13-7-4-3-5-8-13)19-22-17-15(21)11-14(20)12-16(17)26-19/h11-13H,3-10H2,1-2H3/p+1