5-(1,3-benzothiazol-2-yl)-N-[(2R)-2-(furan-2-yl)-2-piperidin-1-ium-1-yl-ethyl]furan-2-carboxamide

Systemtic Name: 5-(1,3-benzothiazol-2-yl)-N-[(2R)-2-(furan-2-yl)-2-piperidin-1-ium-1-yl-ethyl]furan-2-carboxamide Openeye Name: 5-(1,3-benzothiazol-2-yl)-N-[(2R)-2-(2-furyl)-2-piperidin-1-ium-1-yl-ethyl]furan-2-carboxamide CAS Name: 5-(1,3-benzothiazol-2-yl)-N-[(2R)-2-(2-furanyl)-2-(1-piperidin-1-iumyl)ethyl]-2-furancarboxamide IUPAC Name: 5-(1,3-benzothiazol-2-yl)-N-[(2R)-2-(furan-2-yl)-2-piperidin-1-ium-1-ylethyl]furan-2-carboxamide Traditional Name: 5-(1,3-benzothiazol-2-yl)-N-[(2R)-2-(2-furyl)-2-piperidin-1-ium-1-yl-ethyl]-2-furamide Formula: C23H24N3O3S+ MolecularWeight: 422.51996

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)C(CNC(=O)C2=CC=C(O2)C3=NC4=CC=CC=C4S3)C5=CC=CO5

Isomeric SMILES

C1CC[NH+](CC1)[C@H](CNC(=O)C2=CC=C(O2)C3=NC4=CC=CC=C4S3)C5=CC=CO5

InChI

InChI=1S/C23H23N3O3S/c27-22(24-15-17(18-8-6-14-28-18)26-12-4-1-5-13-26)19-10-11-20(29-19)23-25-16-7-2-3-9-21(16)30-23/h2-3,6-11,14,17H,1,4-5,12-13,15H2,(H,24,27)/p+1/t17-/m1/s1