5,6-dimethyl-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)-1H-pyrimidin-4-one

Systemtic Name: 5,6-dimethyl-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)-1H-pyrimidin-4-one Openeye Name: 5,6-dimethyl-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)-1H-pyrimidin-4-one CAS Name: 5,6-dimethyl-2-[4-(2-pyridin-1-iumyl)-1-piperazinyl]-1H-pyrimidin-4-one IUPAC Name: 5,6-dimethyl-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)-1H-pyrimidin-4-one Traditional Name: 5,6-dimethyl-2-(4-pyridin-1-ium-2-ylpiperazino)-1H-pyrimidin-4-one Formula: C15H20N5O+ MolecularWeight: 286.3522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=NC1=O)N2CCN(CC2)C3=CC=CC=[NH+]3)C

Isomeric SMILES

CC1=C(NC(=NC1=O)N2CCN(CC2)C3=CC=CC=[NH+]3)C

InChI

InChI=1S/C15H19N5O/c1-11-12(2)17-15(18-14(11)21)20-9-7-19(8-10-20)13-5-3-4-6-16-13/h3-6H,7-10H2,1-2H3,(H,17,18,21)/p+1