2-[(4-ethoxy-1,3-benzothiazol-2-yl)-(2-fluorophenyl)carbonyl-amino]ethyl-dimethyl-azanium

Systemtic Name: 2-[(4-ethoxy-1,3-benzothiazol-2-yl)-(2-fluorophenyl)carbonyl-amino]ethyl-dimethyl-azanium Openeye Name: 2-[(4-ethoxy-1,3-benzothiazol-2-yl)-(2-fluorobenzoyl)amino]ethyl-dimethyl-ammonium CAS Name: 2-[(4-ethoxy-1,3-benzothiazol-2-yl)-[(2-fluorophenyl)-oxomethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[(4-ethoxy-1,3-benzothiazol-2-yl)-(2-fluorobenzoyl)amino]ethyl-dimethylazanium Traditional Name: 2-[(4-ethoxy-1,3-benzothiazol-2-yl)-(2-fluorobenzoyl)amino]ethyl-dimethyl-ammonium Formula: C20H23FN3O2S+ MolecularWeight: 388.478923

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C2C(=CC=C1)SC(=N2)N(CC[NH+](C)C)C(=O)C3=CC=CC=C3F

Isomeric SMILES

CCOC1=C2C(=CC=C1)SC(=N2)N(CC[NH+](C)C)C(=O)C3=CC=CC=C3F

InChI

InChI=1S/C20H22FN3O2S/c1-4-26-16-10-7-11-17-18(16)22-20(27-17)24(13-12-23(2)3)19(25)14-8-5-6-9-15(14)21/h5-11H,4,12-13H2,1-3H3/p+1