3-(1,3-benzothiazol-2-yl)-N-(3-pyrrolidin-1-ium-1-ylpropyl)propanamide

Systemtic Name: 3-(1,3-benzothiazol-2-yl)-N-(3-pyrrolidin-1-ium-1-ylpropyl)propanamide Openeye Name: 3-(1,3-benzothiazol-2-yl)-N-(3-pyrrolidin-1-ium-1-ylpropyl)propanamide CAS Name: 3-(1,3-benzothiazol-2-yl)-N-[3-(1-pyrrolidin-1-iumyl)propyl]propanamide IUPAC Name: 3-(1,3-benzothiazol-2-yl)-N-(3-pyrrolidin-1-ium-1-ylpropyl)propanamide Traditional Name: 3-(1,3-benzothiazol-2-yl)-N-(3-pyrrolidin-1-ium-1-ylpropyl)propionamide Formula: C17H24N3OS+ MolecularWeight: 318.45696

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CCCNC(=O)CCC2=NC3=CC=CC=C3S2

Isomeric SMILES

C1CC[NH+](C1)CCCNC(=O)CCC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C17H23N3OS/c21-16(18-10-5-13-20-11-3-4-12-20)8-9-17-19-14-6-1-2-7-15(14)22-17/h1-2,6-7H,3-5,8-13H2,(H,18,21)/p+1