N-(6-fluoranyl-1,3-benzothiazol-2-yl)-2,4-dimethyl-N-(2-morpholin-4-ium-4-ylethyl)benzamide

Systemtic Name: N-(6-fluoranyl-1,3-benzothiazol-2-yl)-2,4-dimethyl-N-(2-morpholin-4-ium-4-ylethyl)benzamide Openeye Name: N-(6-fluoro-1,3-benzothiazol-2-yl)-2,4-dimethyl-N-(2-morpholin-4-ium-4-ylethyl)benzamide CAS Name: N-(6-fluoro-1,3-benzothiazol-2-yl)-2,4-dimethyl-N-[2-(4-morpholin-4-iumyl)ethyl]benzamide IUPAC Name: N-(6-fluoro-1,3-benzothiazol-2-yl)-2,4-dimethyl-N-(2-morpholin-4-ium-4-ylethyl)benzamide Traditional Name: N-(6-fluoro-1,3-benzothiazol-2-yl)-2,4-dimethyl-N-(2-morpholin-4-ium-4-ylethyl)benzamide Formula: C22H25FN3O2S+ MolecularWeight: 414.516203

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)N(CC[NH+]2CCOCC2)C3=NC4=C(S3)C=C(C=C4)F)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)N(CC[NH+]2CCOCC2)C3=NC4=C(S3)C=C(C=C4)F)C

InChI

InChI=1S/C22H24FN3O2S/c1-15-3-5-18(16(2)13-15)21(27)26(8-7-25-9-11-28-12-10-25)22-24-19-6-4-17(23)14-20(19)29-22/h3-6,13-14H,7-12H2,1-2H3/p+1