3-(4-ethoxyphenyl)-5-[[4-(4-methoxypyrimidin-2-yl)piperazin-1-yl]methyl]-1,2,4-oxadiazole

Systemtic Name: 3-(4-ethoxyphenyl)-5-[[4-(4-methoxypyrimidin-2-yl)piperazin-1-yl]methyl]-1,2,4-oxadiazole Openeye Name: 3-(4-ethoxyphenyl)-5-[[4-(4-methoxypyrimidin-2-yl)piperazin-1-yl]methyl]-1,2,4-oxadiazole CAS Name: 3-(4-ethoxyphenyl)-5-[[4-(4-methoxy-2-pyrimidinyl)-1-piperazinyl]methyl]-1,2,4-oxadiazole IUPAC Name: 3-(4-ethoxyphenyl)-5-[[4-(4-methoxypyrimidin-2-yl)piperazin-1-yl]methyl]-1,2,4-oxadiazole Traditional Name: 5-[[4-(4-methoxypyrimidin-2-yl)piperazino]methyl]-3-p-phenetyl-1,2,4-oxadiazole Formula: C20H24N6O3 MolecularWeight: 396.44296

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NOC(=N2)CN3CCN(CC3)C4=NC=CC(=N4)OC

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NOC(=N2)CN3CCN(CC3)C4=NC=CC(=N4)OC

InChI

InChI=1S/C20H24N6O3/c1-3-28-16-6-4-15(5-7-16)19-22-18(29-24-19)14-25-10-12-26(13-11-25)20-21-9-8-17(23-20)27-2/h4-9H,3,10-14H2,1-2H3