N-[3-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]propyl]-3-pyridin-4-yl-1,2,4-oxadiazole-5-carboxamide

Systemtic Name: N-[3-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]propyl]-3-pyridin-4-yl-1,2,4-oxadiazole-5-carboxamide Openeye Name: N-[3-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]propyl]-3-(4-pyridyl)-1,2,4-oxadiazole-5-carboxamide CAS Name: N-[3-[4-(3-chlorophenyl)-1-piperazin-1-iumyl]propyl]-3-pyridin-4-yl-1,2,4-oxadiazole-5-carboxamide IUPAC Name: N-[3-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]propyl]-3-pyridin-4-yl-1,2,4-oxadiazole-5-carboxamide Traditional Name: N-[3-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]propyl]-3-(4-pyridyl)-1,2,4-oxadiazole-5-carboxamide Formula: C21H24ClN6O2+ MolecularWeight: 427.90726

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCCNC(=O)C2=NC(=NO2)C3=CC=NC=C3)C4=CC(=CC=C4)Cl

Isomeric SMILES

C1CN(CC[NH+]1CCCNC(=O)C2=NC(=NO2)C3=CC=NC=C3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C21H23ClN6O2/c22-17-3-1-4-18(15-17)28-13-11-27(12-14-28)10-2-7-24-20(29)21-25-19(26-30-21)16-5-8-23-9-6-16/h1,3-6,8-9,15H,2,7,10-14H2,(H,24,29)/p+1