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

Systemtic Name: 2-oxidanylidene-6-[[(2S)-2-pyridin-3-ylpiperidin-1-ium-1-yl]methyl]-N-(thiophen-3-ylmethyl)-1H-pyridine-3-carboxamide Openeye Name: 2-oxo-6-[[(2S)-2-(3-pyridyl)piperidin-1-ium-1-yl]methyl]-N-(3-thienylmethyl)-1H-pyridine-3-carboxamide CAS Name: 2-oxo-6-[[(2S)-2-(3-pyridinyl)-1-piperidin-1-iumyl]methyl]-N-(3-thiophenylmethyl)-1H-pyridine-3-carboxamide IUPAC Name: 2-oxo-6-[[(2S)-2-pyridin-3-ylpiperidin-1-ium-1-yl]methyl]-N-(thiophen-3-ylmethyl)-1H-pyridine-3-carboxamide Traditional Name: 2-keto-6-[[(2S)-2-(3-pyridyl)piperidin-1-ium-1-yl]methyl]-N-(3-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=CSC=C4

Isomeric SMILES

C1CC[NH+]([C@@H](C1)C2=CN=CC=C2)CC3=CC=C(C(=O)N3)C(=O)NCC4=CSC=C4

InChI

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