3-(4-dimethylaminophenyl)-N-[3-(4-methylpiperazin-4-ium-1-yl)propyl]-1,2,4-oxadiazole-5-carboxamide

Systemtic Name: 3-(4-dimethylaminophenyl)-N-[3-(4-methylpiperazin-4-ium-1-yl)propyl]-1,2,4-oxadiazole-5-carboxamide Openeye Name: 3-(4-dimethylaminophenyl)-N-[3-(4-methylpiperazin-4-ium-1-yl)propyl]-1,2,4-oxadiazole-5-carboxamide CAS Name: 3-(4-dimethylaminophenyl)-N-[3-(4-methyl-1-piperazin-4-iumyl)propyl]-1,2,4-oxadiazole-5-carboxamide IUPAC Name: 3-(4-dimethylaminophenyl)-N-[3-(4-methylpiperazin-4-ium-1-yl)propyl]-1,2,4-oxadiazole-5-carboxamide Traditional Name: 3-(4-dimethylaminophenyl)-N-[3-(4-methylpiperazin-4-ium-1-yl)propyl]-1,2,4-oxadiazole-5-carboxamide Formula: C19H29N6O2+ MolecularWeight: 373.47256

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)CCCNC(=O)C2=NC(=NO2)C3=CC=C(C=C3)N(C)C

Isomeric SMILES

C[NH+]1CCN(CC1)CCCNC(=O)C2=NC(=NO2)C3=CC=C(C=C3)N(C)C

InChI

InChI=1S/C19H28N6O2/c1-23(2)16-7-5-15(6-8-16)17-21-19(27-22-17)18(26)20-9-4-10-25-13-11-24(3)12-14-25/h5-8H,4,9-14H2,1-3H3,(H,20,26)/p+1