2-(4-fluorophenyl)-4-methyl-N-(3-morpholin-4-ium-4-ylpropyl)-1,3-thiazole-5-carboxamide

Systemtic Name: 2-(4-fluorophenyl)-4-methyl-N-(3-morpholin-4-ium-4-ylpropyl)-1,3-thiazole-5-carboxamide Openeye Name: 2-(4-fluorophenyl)-4-methyl-N-(3-morpholin-4-ium-4-ylpropyl)thiazole-5-carboxamide CAS Name: 2-(4-fluorophenyl)-4-methyl-N-[3-(4-morpholin-4-iumyl)propyl]-5-thiazolecarboxamide IUPAC Name: 2-(4-fluorophenyl)-4-methyl-N-(3-morpholin-4-ium-4-ylpropyl)-1,3-thiazole-5-carboxamide Traditional Name: 2-(4-fluorophenyl)-4-methyl-N-(3-morpholin-4-ium-4-ylpropyl)thiazole-5-carboxamide Formula: C18H23FN3O2S+ MolecularWeight: 364.457523

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C2=CC=C(C=C2)F)C(=O)NCCC[NH+]3CCOCC3

Isomeric SMILES

CC1=C(SC(=N1)C2=CC=C(C=C2)F)C(=O)NCCC[NH+]3CCOCC3

InChI

InChI=1S/C18H22FN3O2S/c1-13-16(25-18(21-13)14-3-5-15(19)6-4-14)17(23)20-7-2-8-22-9-11-24-12-10-22/h3-6H,2,7-12H2,1H3,(H,20,23)/p+1