2-(4-chlorophenyl)-N-(2-piperidin-1-ium-1-ylethyl)-5-thiophen-2-yl-pyrazole-3-carboxamide

Systemtic Name: 2-(4-chlorophenyl)-N-(2-piperidin-1-ium-1-ylethyl)-5-thiophen-2-yl-pyrazole-3-carboxamide Openeye Name: 2-(4-chlorophenyl)-N-(2-piperidin-1-ium-1-ylethyl)-5-(2-thienyl)pyrazole-3-carboxamide CAS Name: 2-(4-chlorophenyl)-N-[2-(1-piperidin-1-iumyl)ethyl]-5-thiophen-2-yl-3-pyrazolecarboxamide IUPAC Name: 2-(4-chlorophenyl)-N-(2-piperidin-1-ium-1-ylethyl)-5-thiophen-2-ylpyrazole-3-carboxamide Traditional Name: 2-(4-chlorophenyl)-N-(2-piperidin-1-ium-1-ylethyl)-5-(2-thienyl)pyrazole-3-carboxamide Formula: C21H24ClN4OS+ MolecularWeight: 415.95946

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCNC(=O)C2=CC(=NN2C3=CC=C(C=C3)Cl)C4=CC=CS4

Isomeric SMILES

C1CC[NH+](CC1)CCNC(=O)C2=CC(=NN2C3=CC=C(C=C3)Cl)C4=CC=CS4

InChI

InChI=1S/C21H23ClN4OS/c22-16-6-8-17(9-7-16)26-19(15-18(24-26)20-5-4-14-28-20)21(27)23-10-13-25-11-2-1-3-12-25/h4-9,14-15H,1-3,10-13H2,(H,23,27)/p+1