2-[4-acetamido-4-(4-fluorophenyl)piperidin-1-ium-1-yl]-N-(1,3-thiazol-2-yl)ethanamide

Systemtic Name: 2-[4-acetamido-4-(4-fluorophenyl)piperidin-1-ium-1-yl]-N-(1,3-thiazol-2-yl)ethanamide Openeye Name: 2-[4-acetamido-4-(4-fluorophenyl)piperidin-1-ium-1-yl]-N-thiazol-2-yl-acetamide CAS Name: 2-[4-acetamido-4-(4-fluorophenyl)-1-piperidin-1-iumyl]-N-(2-thiazolyl)acetamide IUPAC Name: 2-[4-acetamido-4-(4-fluorophenyl)piperidin-1-ium-1-yl]-N-(1,3-thiazol-2-yl)acetamide Traditional Name: 2-[4-acetamido-4-(4-fluorophenyl)piperidin-1-ium-1-yl]-N-thiazol-2-yl-acetamide Formula: C18H22FN4O2S+ MolecularWeight: 377.456283

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1(CC[NH+](CC1)CC(=O)NC2=NC=CS2)C3=CC=C(C=C3)F

Isomeric SMILES

CC(=O)NC1(CC[NH+](CC1)CC(=O)NC2=NC=CS2)C3=CC=C(C=C3)F

InChI

InChI=1S/C18H21FN4O2S/c1-13(24)22-18(14-2-4-15(19)5-3-14)6-9-23(10-7-18)12-16(25)21-17-20-8-11-26-17/h2-5,8,11H,6-7,9-10,12H2,1H3,(H,22,24)(H,20,21,25)/p+1