5-[(4-chloranylpyrazol-1-yl)methyl]-N-[1-(2-piperidin-1-ium-1-ylethyl)benzimidazol-2-yl]furan-2-carboxamide

Systemtic Name: 5-[(4-chloranylpyrazol-1-yl)methyl]-N-[1-(2-piperidin-1-ium-1-ylethyl)benzimidazol-2-yl]furan-2-carboxamide Openeye Name: 5-[(4-chloropyrazol-1-yl)methyl]-N-[1-(2-piperidin-1-ium-1-ylethyl)benzimidazol-2-yl]furan-2-carboxamide CAS Name: 5-[(4-chloro-1-pyrazolyl)methyl]-N-[1-[2-(1-piperidin-1-iumyl)ethyl]-2-benzimidazolyl]-2-furancarboxamide IUPAC Name: 5-[(4-chloropyrazol-1-yl)methyl]-N-[1-(2-piperidin-1-ium-1-ylethyl)benzimidazol-2-yl]furan-2-carboxamide Traditional Name: 5-[(4-chloropyrazol-1-yl)methyl]-N-[1-(2-piperidin-1-ium-1-ylethyl)benzimidazol-2-yl]-2-furamide Formula: C23H26ClN6O2+ MolecularWeight: 453.94454

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCN2C3=CC=CC=C3N=C2NC(=O)C4=CC=C(O4)CN5C=C(C=N5)Cl

Isomeric SMILES

C1CC[NH+](CC1)CCN2C3=CC=CC=C3N=C2NC(=O)C4=CC=C(O4)CN5C=C(C=N5)Cl

InChI

InChI=1S/C23H25ClN6O2/c24-17-14-25-29(15-17)16-18-8-9-21(32-18)22(31)27-23-26-19-6-2-3-7-20(19)30(23)13-12-28-10-4-1-5-11-28/h2-3,6-9,14-15H,1,4-5,10-13,16H2,(H,26,27,31)/p+1