2-(4-fluorophenyl)-4-methyl-N-[4-(morpholin-4-ium-4-ylmethyl)phenyl]-1,3-thiazole-5-carboxamide

Systemtic Name: 2-(4-fluorophenyl)-4-methyl-N-[4-(morpholin-4-ium-4-ylmethyl)phenyl]-1,3-thiazole-5-carboxamide Openeye Name: 2-(4-fluorophenyl)-4-methyl-N-[4-(morpholin-4-ium-4-ylmethyl)phenyl]thiazole-5-carboxamide CAS Name: 2-(4-fluorophenyl)-4-methyl-N-[4-(4-morpholin-4-iumylmethyl)phenyl]-5-thiazolecarboxamide IUPAC Name: 2-(4-fluorophenyl)-4-methyl-N-[4-(morpholin-4-ium-4-ylmethyl)phenyl]-1,3-thiazole-5-carboxamide Traditional Name: 2-(4-fluorophenyl)-4-methyl-N-[4-(morpholin-4-ium-4-ylmethyl)phenyl]thiazole-5-carboxamide Formula: C22H23FN3O2S+ MolecularWeight: 412.500323

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C2=CC=C(C=C2)F)C(=O)NC3=CC=C(C=C3)C[NH+]4CCOCC4

Isomeric SMILES

CC1=C(SC(=N1)C2=CC=C(C=C2)F)C(=O)NC3=CC=C(C=C3)C[NH+]4CCOCC4

InChI

InChI=1S/C22H22FN3O2S/c1-15-20(29-22(24-15)17-4-6-18(23)7-5-17)21(27)25-19-8-2-16(3-9-19)14-26-10-12-28-13-11-26/h2-9H,10-14H2,1H3,(H,25,27)/p+1