N-[2-(4,6-dimethylpyrimidin-2-yl)-5-methyl-pyrazol-3-yl]-2-pyrrolidin-1-ium-1-yl-ethanamide

Systemtic Name: N-[2-(4,6-dimethylpyrimidin-2-yl)-5-methyl-pyrazol-3-yl]-2-pyrrolidin-1-ium-1-yl-ethanamide Openeye Name: N-[2-(4,6-dimethylpyrimidin-2-yl)-5-methyl-pyrazol-3-yl]-2-pyrrolidin-1-ium-1-yl-acetamide CAS Name: N-[2-(4,6-dimethyl-2-pyrimidinyl)-5-methyl-3-pyrazolyl]-2-(1-pyrrolidin-1-iumyl)acetamide IUPAC Name: N-[2-(4,6-dimethylpyrimidin-2-yl)-5-methylpyrazol-3-yl]-2-pyrrolidin-1-ium-1-ylacetamide Traditional Name: N-[2-(4,6-dimethylpyrimidin-2-yl)-5-methyl-pyrazol-3-yl]-2-pyrrolidin-1-ium-1-yl-acetamide Formula: C16H23N6O+ MolecularWeight: 315.39342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2C(=CC(=N2)C)NC(=O)C[NH+]3CCCC3)C

Isomeric SMILES

CC1=CC(=NC(=N1)N2C(=CC(=N2)C)NC(=O)C[NH+]3CCCC3)C

InChI

InChI=1S/C16H22N6O/c1-11-8-12(2)18-16(17-11)22-14(9-13(3)20-22)19-15(23)10-21-6-4-5-7-21/h8-9H,4-7,10H2,1-3H3,(H,19,23)/p+1