2-(4-fluorophenyl)carbonyl-N-[4-(morpholin-4-ium-4-ylmethyl)-1,3-thiazol-2-yl]benzamide

Systemtic Name: 2-(4-fluorophenyl)carbonyl-N-[4-(morpholin-4-ium-4-ylmethyl)-1,3-thiazol-2-yl]benzamide Openeye Name: 2-(4-fluorobenzoyl)-N-[4-(morpholin-4-ium-4-ylmethyl)thiazol-2-yl]benzamide CAS Name: 2-[(4-fluorophenyl)-oxomethyl]-N-[4-(4-morpholin-4-iumylmethyl)-2-thiazolyl]benzamide IUPAC Name: 2-(4-fluorobenzoyl)-N-[4-(morpholin-4-ium-4-ylmethyl)-1,3-thiazol-2-yl]benzamide Traditional Name: 2-(4-fluorobenzoyl)-N-[4-(morpholin-4-ium-4-ylmethyl)thiazol-2-yl]benzamide Formula: C22H21FN3O3S+ MolecularWeight: 426.483843

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC2=CSC(=N2)NC(=O)C3=CC=CC=C3C(=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1COCC[NH+]1CC2=CSC(=N2)NC(=O)C3=CC=CC=C3C(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H20FN3O3S/c23-16-7-5-15(6-8-16)20(27)18-3-1-2-4-19(18)21(28)25-22-24-17(14-30-22)13-26-9-11-29-12-10-26/h1-8,14H,9-13H2,(H,24,25,28)/p+1