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

Systemtic Name: 2-[4-(6-methyl-2-propan-2-yl-pyrimidin-3-ium-4-yl)piperazin-1-yl]-1,3-benzoxazole Openeye Name: 2-[4-(2-isopropyl-6-methyl-pyrimidin-3-ium-4-yl)piperazin-1-yl]-1,3-benzoxazole CAS Name: 2-[4-(6-methyl-2-propan-2-yl-4-pyrimidin-3-iumyl)-1-piperazinyl]-1,3-benzoxazole IUPAC Name: 2-[4-(6-methyl-2-propan-2-ylpyrimidin-3-ium-4-yl)piperazin-1-yl]-1,3-benzoxazole Traditional Name: 2-[4-(2-isopropyl-6-methyl-pyrimidin-3-ium-4-yl)piperazino]-1,3-benzoxazole Formula: C19H24N5O+ MolecularWeight: 338.42676

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[NH+]C(=N1)C(C)C)N2CCN(CC2)C3=NC4=CC=CC=C4O3

Isomeric SMILES

CC1=CC(=[NH+]C(=N1)C(C)C)N2CCN(CC2)C3=NC4=CC=CC=C4O3

InChI

InChI=1S/C19H23N5O/c1-13(2)18-20-14(3)12-17(22-18)23-8-10-24(11-9-23)19-21-15-6-4-5-7-16(15)25-19/h4-7,12-13H,8-11H2,1-3H3/p+1