6-methyl-2-[(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)methyl]pyrido[1,2-a]pyrimidin-4-one

Systemtic Name: 6-methyl-2-[(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)methyl]pyrido[1,2-a]pyrimidin-4-one Openeye Name: 6-methyl-2-[(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)methyl]pyrido[1,2-a]pyrimidin-4-one CAS Name: 6-methyl-2-[[4-(2-pyrimidinyl)-1-piperazin-1-iumyl]methyl]-4-pyrido[1,2-a]pyrimidinone IUPAC Name: 6-methyl-2-[(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)methyl]pyrido[1,2-a]pyrimidin-4-one Traditional Name: 6-methyl-2-[[4-(2-pyrimidyl)piperazin-1-ium-1-yl]methyl]pyrido[1,2-a]pyrimidin-4-one Formula: C18H21N6O+ MolecularWeight: 337.39894

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=NC(=CC(=O)N12)C[NH+]3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

CC1=CC=CC2=NC(=CC(=O)N12)C[NH+]3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C18H20N6O/c1-14-4-2-5-16-21-15(12-17(25)24(14)16)13-22-8-10-23(11-9-22)18-19-6-3-7-20-18/h2-7,12H,8-11,13H2,1H3/p+1