1-(4-chlorophenyl)-5-(furan-2-yl)-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]pyrazole-3-carboxamide

Systemtic Name: 1-(4-chlorophenyl)-5-(furan-2-yl)-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]pyrazole-3-carboxamide Openeye Name: 1-(4-chlorophenyl)-5-(2-furyl)-N-[(6-morpholinopyridin-1-ium-3-yl)methyl]pyrazole-3-carboxamide CAS Name: 1-(4-chlorophenyl)-5-(2-furanyl)-N-[[6-(4-morpholinyl)-3-pyridin-1-iumyl]methyl]-3-pyrazolecarboxamide IUPAC Name: 1-(4-chlorophenyl)-5-(furan-2-yl)-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]pyrazole-3-carboxamide Traditional Name: 1-(4-chlorophenyl)-5-(2-furyl)-N-[(6-morpholinopyridin-1-ium-3-yl)methyl]pyrazole-3-carboxamide Formula: C24H23ClN5O3+ MolecularWeight: 464.92412

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=[NH+]C=C(C=C2)CNC(=O)C3=NN(C(=C3)C4=CC=CO4)C5=CC=C(C=C5)Cl

Isomeric SMILES

C1COCCN1C2=[NH+]C=C(C=C2)CNC(=O)C3=NN(C(=C3)C4=CC=CO4)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C24H22ClN5O3/c25-18-4-6-19(7-5-18)30-21(22-2-1-11-33-22)14-20(28-30)24(31)27-16-17-3-8-23(26-15-17)29-9-12-32-13-10-29/h1-8,11,14-15H,9-10,12-13,16H2,(H,27,31)/p+1