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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCN(C1=NC2=C(C=CC=C2S1)F)C(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C[NH+](C)CCN(C1=NC2=C(C=CC=C2S1)F)C(=O)C3=CC4=CC=CC=C4C=C3

InChI

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