5-phenyl-N-[(2R)-2-pyrrolidin-1-ium-1-yl-2-thiophen-2-yl-ethyl]-1,2-oxazole-3-carboxamide

Systemtic Name: 5-phenyl-N-[(2R)-2-pyrrolidin-1-ium-1-yl-2-thiophen-2-yl-ethyl]-1,2-oxazole-3-carboxamide Openeye Name: 5-phenyl-N-[(2R)-2-pyrrolidin-1-ium-1-yl-2-(2-thienyl)ethyl]isoxazole-3-carboxamide CAS Name: 5-phenyl-N-[(2R)-2-(1-pyrrolidin-1-iumyl)-2-thiophen-2-ylethyl]-3-isoxazolecarboxamide IUPAC Name: 5-phenyl-N-[(2R)-2-pyrrolidin-1-ium-1-yl-2-thiophen-2-ylethyl]-1,2-oxazole-3-carboxamide Traditional Name: 5-phenyl-N-[(2R)-2-pyrrolidin-1-ium-1-yl-2-(2-thienyl)ethyl]isoxazole-3-carboxamide Formula: C20H22N3O2S+ MolecularWeight: 368.47258

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)C(CNC(=O)C2=NOC(=C2)C3=CC=CC=C3)C4=CC=CS4

Isomeric SMILES

C1CC[NH+](C1)[C@H](CNC(=O)C2=NOC(=C2)C3=CC=CC=C3)C4=CC=CS4

InChI

InChI=1S/C20H21N3O2S/c24-20(16-13-18(25-22-16)15-7-2-1-3-8-15)21-14-17(19-9-6-12-26-19)23-10-4-5-11-23/h1-3,6-9,12-13,17H,4-5,10-11,14H2,(H,21,24)/p+1/t17-/m1/s1