5-[[4-(6-methyl-2-propan-2-yl-pyrimidin-3-ium-4-yl)piperazin-1-yl]methyl]-3-propan-2-yl-1,2,4-oxadiazole

Systemtic Name: 5-[[4-(6-methyl-2-propan-2-yl-pyrimidin-3-ium-4-yl)piperazin-1-yl]methyl]-3-propan-2-yl-1,2,4-oxadiazole Openeye Name: 3-isopropyl-5-[[4-(2-isopropyl-6-methyl-pyrimidin-3-ium-4-yl)piperazin-1-yl]methyl]-1,2,4-oxadiazole CAS Name: 5-[[4-(6-methyl-2-propan-2-yl-4-pyrimidin-3-iumyl)-1-piperazinyl]methyl]-3-propan-2-yl-1,2,4-oxadiazole IUPAC Name: 5-[[4-(6-methyl-2-propan-2-ylpyrimidin-3-ium-4-yl)piperazin-1-yl]methyl]-3-propan-2-yl-1,2,4-oxadiazole Traditional Name: 3-isopropyl-5-[[4-(2-isopropyl-6-methyl-pyrimidin-3-ium-4-yl)piperazino]methyl]-1,2,4-oxadiazole Formula: C18H29N6O+ MolecularWeight: 345.46246

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[NH+]C(=N1)C(C)C)N2CCN(CC2)CC3=NC(=NO3)C(C)C

Isomeric SMILES

CC1=CC(=[NH+]C(=N1)C(C)C)N2CCN(CC2)CC3=NC(=NO3)C(C)C

InChI

InChI=1S/C18H28N6O/c1-12(2)17-19-14(5)10-15(20-17)24-8-6-23(7-9-24)11-16-21-18(13(3)4)22-25-16/h10,12-13H,6-9,11H2,1-5H3/p+1