5-[6-(4-ethylpiperazin-4-ium-1-yl)pyridin-3-yl]-3-[(4-methoxyphenyl)methyl]-1,2,4-oxadiazole

Systemtic Name: 5-[6-(4-ethylpiperazin-4-ium-1-yl)pyridin-3-yl]-3-[(4-methoxyphenyl)methyl]-1,2,4-oxadiazole Openeye Name: 5-[6-(4-ethylpiperazin-4-ium-1-yl)-3-pyridyl]-3-[(4-methoxyphenyl)methyl]-1,2,4-oxadiazole CAS Name: 5-[6-(4-ethyl-1-piperazin-4-iumyl)-3-pyridinyl]-3-[(4-methoxyphenyl)methyl]-1,2,4-oxadiazole IUPAC Name: 5-[6-(4-ethylpiperazin-4-ium-1-yl)pyridin-3-yl]-3-[(4-methoxyphenyl)methyl]-1,2,4-oxadiazole Traditional Name: 5-[6-(4-ethylpiperazin-4-ium-1-yl)-3-pyridyl]-3-p-anisyl-1,2,4-oxadiazole Formula: C21H26N5O2+ MolecularWeight: 380.46344

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=NC=C(C=C2)C3=NC(=NO3)CC4=CC=C(C=C4)OC

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=NC=C(C=C2)C3=NC(=NO3)CC4=CC=C(C=C4)OC

InChI

InChI=1S/C21H25N5O2/c1-3-25-10-12-26(13-11-25)20-9-6-17(15-22-20)21-23-19(24-28-21)14-16-4-7-18(27-2)8-5-16/h4-9,15H,3,10-14H2,1-2H3/p+1