N-[4-(morpholin-4-ylmethyl)phenyl]-2-[(2S)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]ethanamide

Systemtic Name: N-[4-(morpholin-4-ylmethyl)phenyl]-2-[(2S)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]ethanamide Openeye Name: N-[4-(morpholinomethyl)phenyl]-2-[(2S)-2-(2-thienyl)pyrrolidin-1-ium-1-yl]acetamide CAS Name: N-[4-(4-morpholinylmethyl)phenyl]-2-[(2S)-2-thiophen-2-yl-1-pyrrolidin-1-iumyl]acetamide IUPAC Name: N-[4-(morpholin-4-ylmethyl)phenyl]-2-[(2S)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]acetamide Traditional Name: N-[4-(morpholinomethyl)phenyl]-2-[(2S)-2-(2-thienyl)pyrrolidin-1-ium-1-yl]acetamide Formula: C21H28N3O2S+ MolecularWeight: 386.53092

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Descriptors Computed from Structure

Canonical SMILES:

C1CC([NH+](C1)CC(=O)NC2=CC=C(C=C2)CN3CCOCC3)C4=CC=CS4

Isomeric SMILES

C1C[C@H]([NH+](C1)CC(=O)NC2=CC=C(C=C2)CN3CCOCC3)C4=CC=CS4

InChI

InChI=1S/C21H27N3O2S/c25-21(16-24-9-1-3-19(24)20-4-2-14-27-20)22-18-7-5-17(6-8-18)15-23-10-12-26-13-11-23/h2,4-8,14,19H,1,3,9-13,15-16H2,(H,22,25)/p+1/t19-/m0/s1