2-[(4-fluoranyl-1,3-benzothiazol-2-yl)-naphthalen-1-ylcarbonyl-amino]ethyl-dimethyl-azanium

Systemtic Name: 2-[(4-fluoranyl-1,3-benzothiazol-2-yl)-naphthalen-1-ylcarbonyl-amino]ethyl-dimethyl-azanium Openeye Name: 2-[(4-fluoro-1,3-benzothiazol-2-yl)-(naphthalene-1-carbonyl)amino]ethyl-dimethyl-ammonium CAS Name: 2-[(4-fluoro-1,3-benzothiazol-2-yl)-[1-naphthalenyl(oxo)methyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[(4-fluoro-1,3-benzothiazol-2-yl)-(naphthalene-1-carbonyl)amino]ethyl-dimethylazanium Traditional Name: 2-[(4-fluoro-1,3-benzothiazol-2-yl)-(1-naphthoyl)amino]ethyl-dimethyl-ammonium Formula: C22H21FN3OS+ MolecularWeight: 394.485043

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCN(C1=NC2=C(C=CC=C2S1)F)C(=O)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

C[NH+](C)CCN(C1=NC2=C(C=CC=C2S1)F)C(=O)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C22H20FN3OS/c1-25(2)13-14-26(22-24-20-18(23)11-6-12-19(20)28-22)21(27)17-10-5-8-15-7-3-4-9-16(15)17/h3-12H,13-14H2,1-2H3/p+1