3-[(4-methoxyphenoxy)methyl]-5-[(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)methyl]-1,2,4-oxadiazole

Systemtic Name: 3-[(4-methoxyphenoxy)methyl]-5-[(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)methyl]-1,2,4-oxadiazole Openeye Name: 3-[(4-methoxyphenoxy)methyl]-5-[(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)methyl]-1,2,4-oxadiazole CAS Name: 3-[(4-methoxyphenoxy)methyl]-5-[[4-(2-pyrimidinyl)-1-piperazin-1-iumyl]methyl]-1,2,4-oxadiazole IUPAC Name: 3-[(4-methoxyphenoxy)methyl]-5-[(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)methyl]-1,2,4-oxadiazole Traditional Name: 3-[(4-methoxyphenoxy)methyl]-5-[[4-(2-pyrimidyl)piperazin-1-ium-1-yl]methyl]-1,2,4-oxadiazole Formula: C19H23N6O3+ MolecularWeight: 383.42432

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OCC2=NOC(=N2)C[NH+]3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

COC1=CC=C(C=C1)OCC2=NOC(=N2)C[NH+]3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C19H22N6O3/c1-26-15-3-5-16(6-4-15)27-14-17-22-18(28-23-17)13-24-9-11-25(12-10-24)19-20-7-2-8-21-19/h2-8H,9-14H2,1H3/p+1