5-butyl-2-(4-ethylpiperazin-4-ium-1-yl)-6-methyl-1H-pyrimidin-4-one

Systemtic Name: 5-butyl-2-(4-ethylpiperazin-4-ium-1-yl)-6-methyl-1H-pyrimidin-4-one Openeye Name: 5-butyl-2-(4-ethylpiperazin-4-ium-1-yl)-6-methyl-1H-pyrimidin-4-one CAS Name: 5-butyl-2-(4-ethyl-1-piperazin-4-iumyl)-6-methyl-1H-pyrimidin-4-one IUPAC Name: 5-butyl-2-(4-ethylpiperazin-4-ium-1-yl)-6-methyl-1H-pyrimidin-4-one Traditional Name: 5-butyl-2-(4-ethylpiperazin-4-ium-1-yl)-6-methyl-1H-pyrimidin-4-one Formula: C15H27N4O+ MolecularWeight: 279.40108

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(NC(=NC1=O)N2CC[NH+](CC2)CC)C

Isomeric SMILES

CCCCC1=C(NC(=NC1=O)N2CC[NH+](CC2)CC)C

InChI

InChI=1S/C15H26N4O/c1-4-6-7-13-12(3)16-15(17-14(13)20)19-10-8-18(5-2)9-11-19/h4-11H2,1-3H3,(H,16,17,20)/p+1