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

Systemtic Name: 3-(2,3-dimethoxyphenyl)-5-[6-(4-ethylpiperazin-1-yl)pyridin-3-yl]-1,2,4-oxadiazole Openeye Name: 3-(2,3-dimethoxyphenyl)-5-[6-(4-ethylpiperazin-1-yl)-3-pyridyl]-1,2,4-oxadiazole CAS Name: 3-(2,3-dimethoxyphenyl)-5-[6-(4-ethyl-1-piperazinyl)-3-pyridinyl]-1,2,4-oxadiazole IUPAC Name: 3-(2,3-dimethoxyphenyl)-5-[6-(4-ethylpiperazin-1-yl)pyridin-3-yl]-1,2,4-oxadiazole Traditional Name: 3-(2,3-dimethoxyphenyl)-5-[6-(4-ethylpiperazino)-3-pyridyl]-1,2,4-oxadiazole Formula: C21H25N5O3 MolecularWeight: 395.4549

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=NC=C(C=C2)C3=NC(=NO3)C4=C(C(=CC=C4)OC)OC

Isomeric SMILES

CCN1CCN(CC1)C2=NC=C(C=C2)C3=NC(=NO3)C4=C(C(=CC=C4)OC)OC

InChI

InChI=1S/C21H25N5O3/c1-4-25-10-12-26(13-11-25)18-9-8-15(14-22-18)21-23-20(24-29-21)16-6-5-7-17(27-2)19(16)28-3/h5-9,14H,4,10-13H2,1-3H3