6-(1-methylpiperidin-1-ium-4-yl)-2-(3-methyl-1-propyl-pyrazol-4-yl)-1H-pyrimidin-4-one

Systemtic Name: 6-(1-methylpiperidin-1-ium-4-yl)-2-(3-methyl-1-propyl-pyrazol-4-yl)-1H-pyrimidin-4-one Openeye Name: 6-(1-methylpiperidin-1-ium-4-yl)-2-(3-methyl-1-propyl-pyrazol-4-yl)-1H-pyrimidin-4-one CAS Name: 6-(1-methyl-4-piperidin-1-iumyl)-2-(3-methyl-1-propyl-4-pyrazolyl)-1H-pyrimidin-4-one IUPAC Name: 6-(1-methylpiperidin-1-ium-4-yl)-2-(3-methyl-1-propylpyrazol-4-yl)-1H-pyrimidin-4-one Traditional Name: 6-(1-methylpiperidin-1-ium-4-yl)-2-(3-methyl-1-propyl-pyrazol-4-yl)-1H-pyrimidin-4-one Formula: C17H26N5O+ MolecularWeight: 316.42124

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=C(C(=N1)C)C2=NC(=O)C=C(N2)C3CC[NH+](CC3)C

Isomeric SMILES

CCCN1C=C(C(=N1)C)C2=NC(=O)C=C(N2)C3CC[NH+](CC3)C

InChI

InChI=1S/C17H25N5O/c1-4-7-22-11-14(12(2)20-22)17-18-15(10-16(23)19-17)13-5-8-21(3)9-6-13/h10-11,13H,4-9H2,1-3H3,(H,18,19,23)/p+1