3-(2-tert-butyl-5-ethyl-3-oxidanylidene-1H-pyrazol-4-yl)-1-(4-fluorophenyl)-4-pyrrolidin-1-yl-pyrrole-2,5-dione

Systemtic Name: 3-(2-tert-butyl-5-ethyl-3-oxidanylidene-1H-pyrazol-4-yl)-1-(4-fluorophenyl)-4-pyrrolidin-1-yl-pyrrole-2,5-dione Openeye Name: 3-(2-tert-butyl-5-ethyl-3-oxo-1H-pyrazol-4-yl)-1-(4-fluorophenyl)-4-pyrrolidin-1-yl-pyrrole-2,5-dione CAS Name: 3-(2-tert-butyl-5-ethyl-3-oxo-1H-pyrazol-4-yl)-1-(4-fluorophenyl)-4-(1-pyrrolidinyl)pyrrole-2,5-dione IUPAC Name: 3-(2-tert-butyl-5-ethyl-3-oxo-1H-pyrazol-4-yl)-1-(4-fluorophenyl)-4-pyrrolidin-1-ylpyrrole-2,5-dione Traditional Name: 3-(1-tert-butyl-3-ethyl-5-keto-3-pyrazolin-4-yl)-1-(4-fluorophenyl)-4-pyrrolidino-3-pyrroline-2,5-quinone Formula: C23H27FN4O3 MolecularWeight: 426.483883

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=O)N(N1)C(C)(C)C)C2=C(C(=O)N(C2=O)C3=CC=C(C=C3)F)N4CCCC4

Isomeric SMILES

CCC1=C(C(=O)N(N1)C(C)(C)C)C2=C(C(=O)N(C2=O)C3=CC=C(C=C3)F)N4CCCC4

InChI

InChI=1S/C23H27FN4O3/c1-5-16-17(21(30)28(25-16)23(2,3)4)18-19(26-12-6-7-13-26)22(31)27(20(18)29)15-10-8-14(24)9-11-15/h8-11,25H,5-7,12-13H2,1-4H3