5-[(2S)-1-methylpyrrolidin-1-ium-2-yl]-N-(oxan-4-ylmethyl)thiophene-2-carboxamide

Systemtic Name: 5-[(2S)-1-methylpyrrolidin-1-ium-2-yl]-N-(oxan-4-ylmethyl)thiophene-2-carboxamide Openeye Name: 5-[(2S)-1-methylpyrrolidin-1-ium-2-yl]-N-(tetrahydropyran-4-ylmethyl)thiophene-2-carboxamide CAS Name: 5-[(2S)-1-methyl-2-pyrrolidin-1-iumyl]-N-(4-oxanylmethyl)-2-thiophenecarboxamide IUPAC Name: 5-[(2S)-1-methylpyrrolidin-1-ium-2-yl]-N-(oxan-4-ylmethyl)thiophene-2-carboxamide Traditional Name: 5-[(2S)-1-methylpyrrolidin-1-ium-2-yl]-N-(tetrahydropyran-4-ylmethyl)thiophene-2-carboxamide Formula: C16H25N2O2S+ MolecularWeight: 309.4469

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCCC1C2=CC=C(S2)C(=O)NCC3CCOCC3

Isomeric SMILES

C[NH+]1CCC[C@H]1C2=CC=C(S2)C(=O)NCC3CCOCC3

InChI

InChI=1S/C16H24N2O2S/c1-18-8-2-3-13(18)14-4-5-15(21-14)16(19)17-11-12-6-9-20-10-7-12/h4-5,12-13H,2-3,6-11H2,1H3,(H,17,19)/p+1/t13-/m0/s1