N-[[(3R)-1-(2-methylpropyl)pyrrolidin-1-ium-3-yl]methyl]-6-thiomorpholin-4-yl-pyridine-3-carboxamide

Systemtic Name: N-[[(3R)-1-(2-methylpropyl)pyrrolidin-1-ium-3-yl]methyl]-6-thiomorpholin-4-yl-pyridine-3-carboxamide Openeye Name: N-[[(3R)-1-isobutylpyrrolidin-1-ium-3-yl]methyl]-6-thiomorpholino-pyridine-3-carboxamide CAS Name: N-[[(3R)-1-(2-methylpropyl)-3-pyrrolidin-1-iumyl]methyl]-6-thiomorpholin-4-yl-3-pyridinecarboxamide IUPAC Name: N-[[(3R)-1-(2-methylpropyl)pyrrolidin-1-ium-3-yl]methyl]-6-thiomorpholin-4-ylpyridine-3-carboxamide Traditional Name: N-[[(3R)-1-isobutylpyrrolidin-1-ium-3-yl]methyl]-6-thiomorpholino-nicotinamide Formula: C19H31N4OS+ MolecularWeight: 363.54064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C[NH+]1CCC(C1)CNC(=O)C2=CN=C(C=C2)N3CCSCC3

Isomeric SMILES

CC(C)C[NH+]1CC[C@@H](C1)CNC(=O)C2=CN=C(C=C2)N3CCSCC3

InChI

InChI=1S/C19H30N4OS/c1-15(2)13-22-6-5-16(14-22)11-21-19(24)17-3-4-18(20-12-17)23-7-9-25-10-8-23/h3-4,12,15-16H,5-11,13-14H2,1-2H3,(H,21,24)/p+1/t16-/m1/s1