2-ethyl-1-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-6-methyl-4-oxidanylidene-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyridine-3-carboxamide

Systemtic Name: 2-ethyl-1-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-6-methyl-4-oxidanylidene-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyridine-3-carboxamide Openeye Name: 2-ethyl-1-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-6-methyl-4-oxo-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyridine-3-carboxamide CAS Name: 2-ethyl-1-[[(2S)-1-ethyl-2-pyrrolidin-1-iumyl]methyl]-6-methyl-4-oxo-N-[(1,3,5-trimethyl-4-pyrazolyl)methyl]-3-pyridinecarboxamide IUPAC Name: 2-ethyl-1-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-6-methyl-4-oxo-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyridine-3-carboxamide Traditional Name: 2-ethyl-1-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-4-keto-6-methyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]nicotinamide Formula: C23H36N5O2+ MolecularWeight: 414.56424

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=O)C=C(N1CC2CCC[NH+]2CC)C)C(=O)NCC3=C(N(N=C3C)C)C

Isomeric SMILES

CCC1=C(C(=O)C=C(N1C[C@@H]2CCC[NH+]2CC)C)C(=O)NCC3=C(N(N=C3C)C)C

InChI

InChI=1S/C23H35N5O2/c1-7-20-22(23(30)24-13-19-16(4)25-26(6)17(19)5)21(29)12-15(3)28(20)14-18-10-9-11-27(18)8-2/h12,18H,7-11,13-14H2,1-6H3,(H,24,30)/p+1/t18-/m0/s1