4-[[2-[4-(3-fluorophenyl)carbonylpiperazin-1-yl]ethylamino]methylidene]-5-methyl-2-(4-nitrophenyl)pyrazol-3-one

Systemtic Name: 4-[[2-[4-(3-fluorophenyl)carbonylpiperazin-1-yl]ethylamino]methylidene]-5-methyl-2-(4-nitrophenyl)pyrazol-3-one Openeye Name: 4-[[2-[4-(3-fluorobenzoyl)piperazin-1-yl]ethylamino]methylene]-5-methyl-2-(4-nitrophenyl)pyrazol-3-one CAS Name: 4-[[2-[4-[(3-fluorophenyl)-oxomethyl]-1-piperazinyl]ethylamino]methylidene]-5-methyl-2-(4-nitrophenyl)-3-pyrazolone IUPAC Name: 4-[[2-[4-(3-fluorobenzoyl)piperazin-1-yl]ethylamino]methylidene]-5-methyl-2-(4-nitrophenyl)pyrazol-3-one Traditional Name: 4-[[2-[4-(3-fluorobenzoyl)piperazino]ethylamino]methylene]-5-methyl-2-(4-nitrophenyl)-2-pyrazolin-3-one Formula: C24H25FN6O4 MolecularWeight: 480.491503

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CNCCN2CCN(CC2)C(=O)C3=CC(=CC=C3)F)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=NN(C(=O)C1=CNCCN2CCN(CC2)C(=O)C3=CC(=CC=C3)F)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H25FN6O4/c1-17-22(24(33)30(27-17)20-5-7-21(8-6-20)31(34)35)16-26-9-10-28-11-13-29(14-12-28)23(32)18-3-2-4-19(25)15-18/h2-8,15-16,26H,9-14H2,1H3