N-(pyridin-2-ylmethyl)-1-[1-(thiophen-2-ylmethyl)piperidin-1-ium-4-yl]piperidin-1-ium-4-carboxamide

Systemtic Name: N-(pyridin-2-ylmethyl)-1-[1-(thiophen-2-ylmethyl)piperidin-1-ium-4-yl]piperidin-1-ium-4-carboxamide Openeye Name: N-(2-pyridylmethyl)-1-[1-(2-thienylmethyl)piperidin-1-ium-4-yl]piperidin-1-ium-4-carboxamide CAS Name: N-(2-pyridinylmethyl)-1-[1-(thiophen-2-ylmethyl)-4-piperidin-1-iumyl]-4-piperidin-1-iumcarboxamide IUPAC Name: N-(pyridin-2-ylmethyl)-1-[1-(thiophen-2-ylmethyl)piperidin-1-ium-4-yl]piperidin-1-ium-4-carboxamide Traditional Name: N-(2-pyridylmethyl)-1-[1-(2-thenyl)piperidin-1-ium-4-yl]piperidin-1-ium-4-carboxamide Formula: C22H32N4OS+2 MolecularWeight: 400.58068

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)NCC2=CC=CC=N2)C3CC[NH+](CC3)CC4=CC=CS4

Isomeric SMILES

C1C[NH+](CCC1C(=O)NCC2=CC=CC=N2)C3CC[NH+](CC3)CC4=CC=CS4

InChI

InChI=1S/C22H30N4OS/c27-22(24-16-19-4-1-2-10-23-19)18-6-13-26(14-7-18)20-8-11-25(12-9-20)17-21-5-3-15-28-21/h1-5,10,15,18,20H,6-9,11-14,16-17H2,(H,24,27)/p+2