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

Systemtic Name: 3-[[4,6-bis(fluoranyl)-1,3-benzothiazol-2-yl]-thiophen-2-ylcarbonyl-amino]propyl-dimethyl-azanium Openeye Name: 3-[(4,6-difluoro-1,3-benzothiazol-2-yl)-(thiophene-2-carbonyl)amino]propyl-dimethyl-ammonium CAS Name: 3-[(4,6-difluoro-1,3-benzothiazol-2-yl)-[oxo(thiophen-2-yl)methyl]amino]propyl-dimethylammonium IUPAC Name: 3-[(4,6-difluoro-1,3-benzothiazol-2-yl)-(thiophene-2-carbonyl)amino]propyl-dimethylazanium Traditional Name: 3-[(4,6-difluoro-1,3-benzothiazol-2-yl)-(2-thenoyl)amino]propyl-dimethyl-ammonium Formula: C17H18F2N3OS2+ MolecularWeight: 382.471126

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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)C3=CC=CS3

Isomeric SMILES

C[NH+](C)CCCN(C1=NC2=C(C=C(C=C2S1)F)F)C(=O)C3=CC=CS3

InChI

InChI=1S/C17H17F2N3OS2/c1-21(2)6-4-7-22(16(23)13-5-3-8-24-13)17-20-15-12(19)9-11(18)10-14(15)25-17/h3,5,8-10H,4,6-7H2,1-2H3/p+1