N-(5-methyl-1,2-oxazol-3-yl)-2-[4-(1-phenyl-3-pyridin-3-yl-pyrazol-4-yl)carbonylpiperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(5-methyl-1,2-oxazol-3-yl)-2-[4-(1-phenyl-3-pyridin-3-yl-pyrazol-4-yl)carbonylpiperazin-1-ium-1-yl]ethanamide Openeye Name: N-(5-methylisoxazol-3-yl)-2-[4-[1-phenyl-3-(3-pyridyl)pyrazole-4-carbonyl]piperazin-1-ium-1-yl]acetamide CAS Name: N-(5-methyl-3-isoxazolyl)-2-[4-[oxo-[1-phenyl-3-(3-pyridinyl)-4-pyrazolyl]methyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(5-methyl-1,2-oxazol-3-yl)-2-[4-(1-phenyl-3-pyridin-3-ylpyrazole-4-carbonyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-(5-methylisoxazol-3-yl)-2-[4-[1-phenyl-3-(3-pyridyl)pyrazole-4-carbonyl]piperazin-1-ium-1-yl]acetamide Formula: C25H26N7O3+ MolecularWeight: 472.51904

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)C[NH+]2CCN(CC2)C(=O)C3=CN(N=C3C4=CN=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC(=NO1)NC(=O)C[NH+]2CCN(CC2)C(=O)C3=CN(N=C3C4=CN=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C25H25N7O3/c1-18-14-22(29-35-18)27-23(33)17-30-10-12-31(13-11-30)25(34)21-16-32(20-7-3-2-4-8-20)28-24(21)19-6-5-9-26-15-19/h2-9,14-16H,10-13,17H2,1H3,(H,27,29,33)/p+1