2-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]-N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]ethanamide

Systemtic Name: 2-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]-N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]ethanamide Openeye Name: 2-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]-N-[6-(3-oxopiperazin-1-yl)-3-pyridyl]acetamide CAS Name: 2-[3-(4-nitrophenyl)-1-phenyl-4-pyrazolyl]-N-[6-(3-oxo-1-piperazinyl)-3-pyridinyl]acetamide IUPAC Name: 2-[3-(4-nitrophenyl)-1-phenylpyrazol-4-yl]-N-[6-(3-oxopiperazin-1-yl)pyridin-3-yl]acetamide Traditional Name: N-[6-(3-ketopiperazino)-3-pyridyl]-2-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]acetamide Formula: C26H23N7O4 MolecularWeight: 497.50532

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)C2=NC=C(C=C2)NC(=O)CC3=CN(N=C3C4=CC=C(C=C4)[N+](=O)[O-])C5=CC=CC=C5

Isomeric SMILES

C1CN(CC(=O)N1)C2=NC=C(C=C2)NC(=O)CC3=CN(N=C3C4=CC=C(C=C4)[N+](=O)[O-])C5=CC=CC=C5

InChI

InChI=1S/C26H23N7O4/c34-24(29-20-8-11-23(28-15-20)31-13-12-27-25(35)17-31)14-19-16-32(21-4-2-1-3-5-21)30-26(19)18-6-9-22(10-7-18)33(36)37/h1-11,15-16H,12-14,17H2,(H,27,35)(H,29,34)