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

Systemtic Name: 5-[[4-(4-methoxypyrimidin-2-yl)piperazin-1-ium-1-yl]methyl]-3-(4-methylphenyl)-1,2,4-oxadiazole Openeye Name: 5-[[4-(4-methoxypyrimidin-2-yl)piperazin-1-ium-1-yl]methyl]-3-(p-tolyl)-1,2,4-oxadiazole CAS Name: 5-[[4-(4-methoxy-2-pyrimidinyl)-1-piperazin-1-iumyl]methyl]-3-(4-methylphenyl)-1,2,4-oxadiazole IUPAC Name: 5-[[4-(4-methoxypyrimidin-2-yl)piperazin-1-ium-1-yl]methyl]-3-(4-methylphenyl)-1,2,4-oxadiazole Traditional Name: 5-[[4-(4-methoxypyrimidin-2-yl)piperazin-1-ium-1-yl]methyl]-3-(p-tolyl)-1,2,4-oxadiazole Formula: C19H23N6O2+ MolecularWeight: 367.42492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NOC(=N2)C[NH+]3CCN(CC3)C4=NC=CC(=N4)OC

Isomeric SMILES

CC1=CC=C(C=C1)C2=NOC(=N2)C[NH+]3CCN(CC3)C4=NC=CC(=N4)OC

InChI

InChI=1S/C19H22N6O2/c1-14-3-5-15(6-4-14)18-21-17(27-23-18)13-24-9-11-25(12-10-24)19-20-8-7-16(22-19)26-2/h3-8H,9-13H2,1-2H3/p+1