N-[5-tert-butyl-2-(4-fluorophenyl)pyrazol-3-yl]-2-morpholin-4-yl-5-nitro-benzamide

Systemtic Name: N-[5-tert-butyl-2-(4-fluorophenyl)pyrazol-3-yl]-2-morpholin-4-yl-5-nitro-benzamide Openeye Name: N-[5-tert-butyl-2-(4-fluorophenyl)pyrazol-3-yl]-2-morpholino-5-nitro-benzamide CAS Name: N-[5-tert-butyl-2-(4-fluorophenyl)-3-pyrazolyl]-2-(4-morpholinyl)-5-nitrobenzamide IUPAC Name: N-[5-tert-butyl-2-(4-fluorophenyl)pyrazol-3-yl]-2-morpholin-4-yl-5-nitrobenzamide Traditional Name: N-[5-tert-butyl-2-(4-fluorophenyl)pyrazol-3-yl]-2-morpholino-5-nitro-benzamide Formula: C24H26FN5O4 MolecularWeight: 467.492743

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCOCC3)C4=CC=C(C=C4)F

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCOCC3)C4=CC=C(C=C4)F

InChI

InChI=1S/C24H26FN5O4/c1-24(2,3)21-15-22(29(27-21)17-6-4-16(25)5-7-17)26-23(31)19-14-18(30(32)33)8-9-20(19)28-10-12-34-13-11-28/h4-9,14-15H,10-13H2,1-3H3,(H,26,31)