4-[[2-(4-cyclopropylcarbonylpiperazin-1-yl)ethylamino]methylidene]-2-(4-nitrophenyl)-5-phenyl-pyrazol-3-one

Systemtic Name: 4-[[2-(4-cyclopropylcarbonylpiperazin-1-yl)ethylamino]methylidene]-2-(4-nitrophenyl)-5-phenyl-pyrazol-3-one Openeye Name: 4-[[2-[4-(cyclopropanecarbonyl)piperazin-1-yl]ethylamino]methylene]-2-(4-nitrophenyl)-5-phenyl-pyrazol-3-one CAS Name: 4-[[2-[4-[cyclopropyl(oxo)methyl]-1-piperazinyl]ethylamino]methylidene]-2-(4-nitrophenyl)-5-phenyl-3-pyrazolone IUPAC Name: 4-[[2-[4-(cyclopropanecarbonyl)piperazin-1-yl]ethylamino]methylidene]-2-(4-nitrophenyl)-5-phenylpyrazol-3-one Traditional Name: 4-[[2-[4-(cyclopropanecarbonyl)piperazino]ethylamino]methylene]-2-(4-nitrophenyl)-5-phenyl-2-pyrazolin-3-one Formula: C26H28N6O4 MolecularWeight: 488.53832

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)N2CCN(CC2)CCNC=C3C(=NN(C3=O)C4=CC=C(C=C4)[N+](=O)[O-])C5=CC=CC=C5

Isomeric SMILES

C1CC1C(=O)N2CCN(CC2)CCNC=C3C(=NN(C3=O)C4=CC=C(C=C4)[N+](=O)[O-])C5=CC=CC=C5

InChI

InChI=1S/C26H28N6O4/c33-25(20-6-7-20)30-16-14-29(15-17-30)13-12-27-18-23-24(19-4-2-1-3-5-19)28-31(26(23)34)21-8-10-22(11-9-21)32(35)36/h1-5,8-11,18,20,27H,6-7,12-17H2