2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)-N-(1,3,5-trimethylpyrazol-4-yl)ethanamide

Systemtic Name: 2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)-N-(1,3,5-trimethylpyrazol-4-yl)ethanamide Openeye Name: 2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)-N-(1,3,5-trimethylpyrazol-4-yl)acetamide CAS Name: 2-[4-(2-pyrimidinyl)-1-piperazin-1-iumyl]-N-(1,3,5-trimethyl-4-pyrazolyl)acetamide IUPAC Name: 2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)-N-(1,3,5-trimethylpyrazol-4-yl)acetamide Traditional Name: 2-[4-(2-pyrimidyl)piperazin-1-ium-1-yl]-N-(1,3,5-trimethylpyrazol-4-yl)acetamide Formula: C16H24N7O+ MolecularWeight: 330.40806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)NC(=O)C[NH+]2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

CC1=C(C(=NN1C)C)NC(=O)C[NH+]2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C16H23N7O/c1-12-15(13(2)21(3)20-12)19-14(24)11-22-7-9-23(10-8-22)16-17-5-4-6-18-16/h4-6H,7-11H2,1-3H3,(H,19,24)/p+1