2-(4-ethylpiperazin-4-ium-1-yl)-6-phenyl-1H-pyrimidin-4-one

Systemtic Name: 2-(4-ethylpiperazin-4-ium-1-yl)-6-phenyl-1H-pyrimidin-4-one Openeye Name: 2-(4-ethylpiperazin-4-ium-1-yl)-6-phenyl-1H-pyrimidin-4-one CAS Name: 2-(4-ethyl-1-piperazin-4-iumyl)-6-phenyl-1H-pyrimidin-4-one IUPAC Name: 2-(4-ethylpiperazin-4-ium-1-yl)-6-phenyl-1H-pyrimidin-4-one Traditional Name: 2-(4-ethylpiperazin-4-ium-1-yl)-6-phenyl-1H-pyrimidin-4-one Formula: C16H21N4O+ MolecularWeight: 285.36414

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=NC(=O)C=C(N2)C3=CC=CC=C3

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=NC(=O)C=C(N2)C3=CC=CC=C3

InChI

InChI=1S/C16H20N4O/c1-2-19-8-10-20(11-9-19)16-17-14(12-15(21)18-16)13-6-4-3-5-7-13/h3-7,12H,2,8-11H2,1H3,(H,17,18,21)/p+1