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

Systemtic Name: 3-(3-chlorophenyl)-5-[6-(4-ethylpiperazin-4-ium-1-yl)pyridin-3-yl]-1,2,4-oxadiazole Openeye Name: 3-(3-chlorophenyl)-5-[6-(4-ethylpiperazin-4-ium-1-yl)-3-pyridyl]-1,2,4-oxadiazole CAS Name: 3-(3-chlorophenyl)-5-[6-(4-ethyl-1-piperazin-4-iumyl)-3-pyridinyl]-1,2,4-oxadiazole IUPAC Name: 3-(3-chlorophenyl)-5-[6-(4-ethylpiperazin-4-ium-1-yl)pyridin-3-yl]-1,2,4-oxadiazole Traditional Name: 3-(3-chlorophenyl)-5-[6-(4-ethylpiperazin-4-ium-1-yl)-3-pyridyl]-1,2,4-oxadiazole Formula: C19H21ClN5O+ MolecularWeight: 370.85594

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20ClN5O/c1-2-24-8-10-25(11-9-24)17-7-6-15(13-21-17)19-22-18(23-26-19)14-4-3-5-16(20)12-14/h3-7,12-13H,2,8-11H2,1H3/p+1