N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]-2-(2-thiophen-2-yl-1,3-thiazol-4-yl)ethanamide

Systemtic Name: N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]-2-(2-thiophen-2-yl-1,3-thiazol-4-yl)ethanamide Openeye Name: N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]-2-[2-(2-thienyl)thiazol-4-yl]acetamide CAS Name: N-[[2-(1-pyrrolidin-1-iumylmethyl)phenyl]methyl]-2-(2-thiophen-2-yl-4-thiazolyl)acetamide IUPAC Name: N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]-2-(2-thiophen-2-yl-1,3-thiazol-4-yl)acetamide Traditional Name: N-[2-(pyrrolidin-1-ium-1-ylmethyl)benzyl]-2-[2-(2-thienyl)thiazol-4-yl]acetamide Formula: C21H24N3OS2+ MolecularWeight: 398.56476

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC2=CC=CC=C2CNC(=O)CC3=CSC(=N3)C4=CC=CS4

Isomeric SMILES

C1CC[NH+](C1)CC2=CC=CC=C2CNC(=O)CC3=CSC(=N3)C4=CC=CS4

InChI

InChI=1S/C21H23N3OS2/c25-20(12-18-15-27-21(23-18)19-8-5-11-26-19)22-13-16-6-1-2-7-17(16)14-24-9-3-4-10-24/h1-2,5-8,11,15H,3-4,9-10,12-14H2,(H,22,25)/p+1