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

Systemtic Name: 7-methyl-2-[(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)methyl]pyrido[1,2-a]pyrimidin-4-one Openeye Name: 7-methyl-2-[(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)methyl]pyrido[1,2-a]pyrimidin-4-one CAS Name: 7-methyl-2-[[4-(2-pyrimidinyl)-1-piperazin-1-iumyl]methyl]-4-pyrido[1,2-a]pyrimidinone IUPAC Name: 7-methyl-2-[(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)methyl]pyrido[1,2-a]pyrimidin-4-one Traditional Name: 7-methyl-2-[[4-(2-pyrimidyl)piperazin-1-ium-1-yl]methyl]pyrido[1,2-a]pyrimidin-4-one Formula: C18H21N6O+ MolecularWeight: 337.39894

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN2C(=NC(=CC2=O)C[NH+]3CCN(CC3)C4=NC=CC=N4)C=C1

Isomeric SMILES

CC1=CN2C(=NC(=CC2=O)C[NH+]3CCN(CC3)C4=NC=CC=N4)C=C1

InChI

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