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

Systemtic Name: 6-phenyl-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)-1H-pyrimidin-4-one Openeye Name: 6-phenyl-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)-1H-pyrimidin-4-one CAS Name: 6-phenyl-2-[4-(2-pyridin-1-iumyl)-1-piperazinyl]-1H-pyrimidin-4-one IUPAC Name: 6-phenyl-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)-1H-pyrimidin-4-one Traditional Name: 6-phenyl-2-(4-pyridin-1-ium-2-ylpiperazino)-1H-pyrimidin-4-one Formula: C19H20N5O+ MolecularWeight: 334.395

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=[NH+]2)C3=NC(=O)C=C(N3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=CC=CC=[NH+]2)C3=NC(=O)C=C(N3)C4=CC=CC=C4

InChI

InChI=1S/C19H19N5O/c25-18-14-16(15-6-2-1-3-7-15)21-19(22-18)24-12-10-23(11-13-24)17-8-4-5-9-20-17/h1-9,14H,10-13H2,(H,21,22,25)/p+1