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

Systemtic Name: 2-[2-(pyrrolidin-1-ium-1-ylmethyl)-4-thiophen-2-yl-phenoxy]-N-(1,3-thiazol-2-ylmethyl)ethanamide Openeye Name: 2-[2-(pyrrolidin-1-ium-1-ylmethyl)-4-(2-thienyl)phenoxy]-N-(thiazol-2-ylmethyl)acetamide CAS Name: 2-[2-(1-pyrrolidin-1-iumylmethyl)-4-thiophen-2-ylphenoxy]-N-(2-thiazolylmethyl)acetamide IUPAC Name: 2-[2-(pyrrolidin-1-ium-1-ylmethyl)-4-thiophen-2-ylphenoxy]-N-(1,3-thiazol-2-ylmethyl)acetamide Traditional Name: 2-[2-(pyrrolidin-1-ium-1-ylmethyl)-4-(2-thienyl)phenoxy]-N-(thiazol-2-ylmethyl)acetamide Formula: C21H24N3O2S2+ MolecularWeight: 414.56416

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC2=C(C=CC(=C2)C3=CC=CS3)OCC(=O)NCC4=NC=CS4

Isomeric SMILES

C1CC[NH+](C1)CC2=C(C=CC(=C2)C3=CC=CS3)OCC(=O)NCC4=NC=CS4

InChI

InChI=1S/C21H23N3O2S2/c25-20(23-13-21-22-7-11-28-21)15-26-18-6-5-16(19-4-3-10-27-19)12-17(18)14-24-8-1-2-9-24/h3-7,10-12H,1-2,8-9,13-15H2,(H,23,25)/p+1