5-bromanyl-N-[(2S)-2-pyrrolidin-1-ium-1-yl-2-thiophen-2-yl-ethyl]furan-2-carboxamide

Systemtic Name: 5-bromanyl-N-[(2S)-2-pyrrolidin-1-ium-1-yl-2-thiophen-2-yl-ethyl]furan-2-carboxamide Openeye Name: 5-bromo-N-[(2S)-2-pyrrolidin-1-ium-1-yl-2-(2-thienyl)ethyl]furan-2-carboxamide CAS Name: 5-bromo-N-[(2S)-2-(1-pyrrolidin-1-iumyl)-2-thiophen-2-ylethyl]-2-furancarboxamide IUPAC Name: 5-bromo-N-[(2S)-2-pyrrolidin-1-ium-1-yl-2-thiophen-2-ylethyl]furan-2-carboxamide Traditional Name: 5-bromo-N-[(2S)-2-pyrrolidin-1-ium-1-yl-2-(2-thienyl)ethyl]-2-furamide Formula: C15H18BrN2O2S+ MolecularWeight: 370.28462

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)C(CNC(=O)C2=CC=C(O2)Br)C3=CC=CS3

Isomeric SMILES

C1CC[NH+](C1)[C@@H](CNC(=O)C2=CC=C(O2)Br)C3=CC=CS3

InChI

InChI=1S/C15H17BrN2O2S/c16-14-6-5-12(20-14)15(19)17-10-11(13-4-3-9-21-13)18-7-1-2-8-18/h3-6,9,11H,1-2,7-8,10H2,(H,17,19)/p+1/t11-/m0/s1