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

Systemtic Name: 2-ethyl-1-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-6-methyl-4-oxidanylidene-N-[(4-phenyl-1,3-thiazol-2-yl)methyl]pyridine-3-carboxamide Openeye Name: 2-ethyl-1-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-6-methyl-4-oxo-N-[(4-phenylthiazol-2-yl)methyl]pyridine-3-carboxamide CAS Name: 2-ethyl-1-[[(2S)-1-ethyl-2-pyrrolidin-1-iumyl]methyl]-6-methyl-4-oxo-N-[(4-phenyl-2-thiazolyl)methyl]-3-pyridinecarboxamide IUPAC Name: 2-ethyl-1-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-6-methyl-4-oxo-N-[(4-phenyl-1,3-thiazol-2-yl)methyl]pyridine-3-carboxamide Traditional Name: 2-ethyl-1-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-4-keto-6-methyl-N-[(4-phenylthiazol-2-yl)methyl]nicotinamide Formula: C26H33N4O2S+ MolecularWeight: 465.63082

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=O)C=C(N1CC2CCC[NH+]2CC)C)C(=O)NCC3=NC(=CS3)C4=CC=CC=C4

Isomeric SMILES

CCC1=C(C(=O)C=C(N1C[C@@H]2CCC[NH+]2CC)C)C(=O)NCC3=NC(=CS3)C4=CC=CC=C4

InChI

InChI=1S/C26H32N4O2S/c1-4-22-25(23(31)14-18(3)30(22)16-20-12-9-13-29(20)5-2)26(32)27-15-24-28-21(17-33-24)19-10-7-6-8-11-19/h6-8,10-11,14,17,20H,4-5,9,12-13,15-16H2,1-3H3,(H,27,32)/p+1/t20-/m0/s1