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

Systemtic Name: 2-(4-fluorophenyl)-4-methyl-N-(2-morpholin-4-ium-4-ylethyl)-1,3-thiazole-5-carboxamide Openeye Name: 2-(4-fluorophenyl)-4-methyl-N-(2-morpholin-4-ium-4-ylethyl)thiazole-5-carboxamide CAS Name: 2-(4-fluorophenyl)-4-methyl-N-[2-(4-morpholin-4-iumyl)ethyl]-5-thiazolecarboxamide IUPAC Name: 2-(4-fluorophenyl)-4-methyl-N-(2-morpholin-4-ium-4-ylethyl)-1,3-thiazole-5-carboxamide Traditional Name: 2-(4-fluorophenyl)-4-methyl-N-(2-morpholin-4-ium-4-ylethyl)thiazole-5-carboxamide Formula: C17H21FN3O2S+ MolecularWeight: 350.430943

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20FN3O2S/c1-12-15(16(22)19-6-7-21-8-10-23-11-9-21)24-17(20-12)13-2-4-14(18)5-3-13/h2-5H,6-11H2,1H3,(H,19,22)/p+1