5-[6-(3-ethyl-4-methyl-piperazin-1-yl)pyridin-3-yl]-3-(phenylmethyl)-1,2,4-oxadiazole

Systemtic Name: 5-[6-(3-ethyl-4-methyl-piperazin-1-yl)pyridin-3-yl]-3-(phenylmethyl)-1,2,4-oxadiazole Openeye Name: 3-benzyl-5-[6-(3-ethyl-4-methyl-piperazin-1-yl)-3-pyridyl]-1,2,4-oxadiazole CAS Name: 5-[6-(3-ethyl-4-methyl-1-piperazinyl)-3-pyridinyl]-3-(phenylmethyl)-1,2,4-oxadiazole IUPAC Name: 3-benzyl-5-[6-(3-ethyl-4-methylpiperazin-1-yl)pyridin-3-yl]-1,2,4-oxadiazole Traditional Name: 3-benzyl-5-[6-(3-ethyl-4-methyl-piperazino)-3-pyridyl]-1,2,4-oxadiazole Formula: C21H25N5O MolecularWeight: 363.4561

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CN(CCN1C)C2=NC=C(C=C2)C3=NC(=NO3)CC4=CC=CC=C4

Isomeric SMILES

CCC1CN(CCN1C)C2=NC=C(C=C2)C3=NC(=NO3)CC4=CC=CC=C4

InChI

InChI=1S/C21H25N5O/c1-3-18-15-26(12-11-25(18)2)20-10-9-17(14-22-20)21-23-19(24-27-21)13-16-7-5-4-6-8-16/h4-10,14,18H,3,11-13,15H2,1-2H3