4-(1,3-dithiolan-2-yl)-N-(3-pyrrolidin-1-ium-1-ylpropyl)benzamide

Systemtic Name: 4-(1,3-dithiolan-2-yl)-N-(3-pyrrolidin-1-ium-1-ylpropyl)benzamide Openeye Name: 4-(1,3-dithiolan-2-yl)-N-(3-pyrrolidin-1-ium-1-ylpropyl)benzamide CAS Name: 4-(1,3-dithiolan-2-yl)-N-[3-(1-pyrrolidin-1-iumyl)propyl]benzamide IUPAC Name: 4-(1,3-dithiolan-2-yl)-N-(3-pyrrolidin-1-ium-1-ylpropyl)benzamide Traditional Name: 4-(1,3-dithiolan-2-yl)-N-(3-pyrrolidin-1-ium-1-ylpropyl)benzamide Formula: C17H25N2OS2+ MolecularWeight: 337.5232

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CCCNC(=O)C2=CC=C(C=C2)C3SCCS3

Isomeric SMILES

C1CC[NH+](C1)CCCNC(=O)C2=CC=C(C=C2)C3SCCS3

InChI

InChI=1S/C17H24N2OS2/c20-16(18-8-3-11-19-9-1-2-10-19)14-4-6-15(7-5-14)17-21-12-13-22-17/h4-7,17H,1-3,8-13H2,(H,18,20)/p+1