5-bromanyl-N-[(2R)-2-(4-methylpiperidin-1-ium-1-yl)-2-thiophen-2-yl-ethyl]pyridine-3-carboxamide

Systemtic Name: 5-bromanyl-N-[(2R)-2-(4-methylpiperidin-1-ium-1-yl)-2-thiophen-2-yl-ethyl]pyridine-3-carboxamide Openeye Name: 5-bromo-N-[(2R)-2-(4-methylpiperidin-1-ium-1-yl)-2-(2-thienyl)ethyl]pyridine-3-carboxamide CAS Name: 5-bromo-N-[(2R)-2-(4-methyl-1-piperidin-1-iumyl)-2-thiophen-2-ylethyl]-3-pyridinecarboxamide IUPAC Name: 5-bromo-N-[(2R)-2-(4-methylpiperidin-1-ium-1-yl)-2-thiophen-2-ylethyl]pyridine-3-carboxamide Traditional Name: 5-bromo-N-[(2R)-2-(4-methylpiperidin-1-ium-1-yl)-2-(2-thienyl)ethyl]nicotinamide Formula: C18H23BrN3OS+ MolecularWeight: 409.36372

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)C(CNC(=O)C2=CC(=CN=C2)Br)C3=CC=CS3

Isomeric SMILES

CC1CC[NH+](CC1)[C@H](CNC(=O)C2=CC(=CN=C2)Br)C3=CC=CS3

InChI

InChI=1S/C18H22BrN3OS/c1-13-4-6-22(7-5-13)16(17-3-2-8-24-17)12-21-18(23)14-9-15(19)11-20-10-14/h2-3,8-11,13,16H,4-7,12H2,1H3,(H,21,23)/p+1/t16-/m1/s1