2-oxidanylidene-6-[[(2S)-2-pyridin-3-ylpiperidin-1-ium-1-yl]methyl]-N-(thiophen-2-ylmethyl)-1H-pyridine-3-carboxamide

Systemtic Name: 2-oxidanylidene-6-[[(2S)-2-pyridin-3-ylpiperidin-1-ium-1-yl]methyl]-N-(thiophen-2-ylmethyl)-1H-pyridine-3-carboxamide Openeye Name: 2-oxo-6-[[(2S)-2-(3-pyridyl)piperidin-1-ium-1-yl]methyl]-N-(2-thienylmethyl)-1H-pyridine-3-carboxamide CAS Name: 2-oxo-6-[[(2S)-2-(3-pyridinyl)-1-piperidin-1-iumyl]methyl]-N-(thiophen-2-ylmethyl)-1H-pyridine-3-carboxamide IUPAC Name: 2-oxo-6-[[(2S)-2-pyridin-3-ylpiperidin-1-ium-1-yl]methyl]-N-(thiophen-2-ylmethyl)-1H-pyridine-3-carboxamide Traditional Name: 2-keto-6-[[(2S)-2-(3-pyridyl)piperidin-1-ium-1-yl]methyl]-N-(2-thenyl)-1H-pyridine-3-carboxamide Formula: C22H25N4O2S+ MolecularWeight: 409.5245

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C(C1)C2=CN=CC=C2)CC3=CC=C(C(=O)N3)C(=O)NCC4=CC=CS4

Isomeric SMILES

C1CC[NH+]([C@@H](C1)C2=CN=CC=C2)CC3=CC=C(C(=O)N3)C(=O)NCC4=CC=CS4

InChI

InChI=1S/C22H24N4O2S/c27-21(24-14-18-6-4-12-29-18)19-9-8-17(25-22(19)28)15-26-11-2-1-7-20(26)16-5-3-10-23-13-16/h3-6,8-10,12-13,20H,1-2,7,11,14-15H2,(H,24,27)(H,25,28)/p+1/t20-/m0/s1