N-[4-[3,4-bis(fluoranyl)phenyl]-1,3-thiazol-2-yl]-2-piperidin-1-ium-1-yl-ethanamide

Systemtic Name: N-[4-[3,4-bis(fluoranyl)phenyl]-1,3-thiazol-2-yl]-2-piperidin-1-ium-1-yl-ethanamide Openeye Name: N-[4-(3,4-difluorophenyl)thiazol-2-yl]-2-piperidin-1-ium-1-yl-acetamide CAS Name: N-[4-(3,4-difluorophenyl)-2-thiazolyl]-2-(1-piperidin-1-iumyl)acetamide IUPAC Name: N-[4-(3,4-difluorophenyl)-1,3-thiazol-2-yl]-2-piperidin-1-ium-1-ylacetamide Traditional Name: N-[4-(3,4-difluorophenyl)thiazol-2-yl]-2-piperidin-1-ium-1-yl-acetamide Formula: C16H18F2N3OS+ MolecularWeight: 338.395426

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC(=O)NC2=NC(=CS2)C3=CC(=C(C=C3)F)F

Isomeric SMILES

C1CC[NH+](CC1)CC(=O)NC2=NC(=CS2)C3=CC(=C(C=C3)F)F

InChI

InChI=1S/C16H17F2N3OS/c17-12-5-4-11(8-13(12)18)14-10-23-16(19-14)20-15(22)9-21-6-2-1-3-7-21/h4-5,8,10H,1-3,6-7,9H2,(H,19,20,22)/p+1