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

Systemtic Name: 5-phenyl-2-[(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)methyl]-1,3-oxazole Openeye Name: 5-phenyl-2-[(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)methyl]oxazole CAS Name: 5-phenyl-2-[[4-(2-pyrimidinyl)-1-piperazin-1-iumyl]methyl]oxazole IUPAC Name: 5-phenyl-2-[(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)methyl]-1,3-oxazole Traditional Name: 5-phenyl-2-[[4-(2-pyrimidyl)piperazin-1-ium-1-yl]methyl]oxazole Formula: C18H20N5O+ MolecularWeight: 322.3843

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=NC=C(O2)C3=CC=CC=C3)C4=NC=CC=N4

Isomeric SMILES

C1CN(CC[NH+]1CC2=NC=C(O2)C3=CC=CC=C3)C4=NC=CC=N4

InChI

InChI=1S/C18H19N5O/c1-2-5-15(6-3-1)16-13-21-17(24-16)14-22-9-11-23(12-10-22)18-19-7-4-8-20-18/h1-8,13H,9-12,14H2/p+1