3-[1-(4-tert-butylphenyl)carbonyl-5-(2-fluorophenyl)pyrazolidin-3-ylidene]-6-chloranyl-4-phenyl-quinolin-2-one

Systemtic Name: 3-[1-(4-tert-butylphenyl)carbonyl-5-(2-fluorophenyl)pyrazolidin-3-ylidene]-6-chloranyl-4-phenyl-quinolin-2-one Openeye Name: 3-[1-(4-tert-butylbenzoyl)-5-(2-fluorophenyl)pyrazolidin-3-ylidene]-6-chloro-4-phenyl-quinolin-2-one CAS Name: 3-[1-[(4-tert-butylphenyl)-oxomethyl]-5-(2-fluorophenyl)-3-pyrazolidinylidene]-6-chloro-4-phenyl-2-quinolinone IUPAC Name: 3-[1-(4-tert-butylbenzoyl)-5-(2-fluorophenyl)pyrazolidin-3-ylidene]-6-chloro-4-phenylquinolin-2-one Traditional Name: 3-[1-(4-tert-butylbenzoyl)-5-(2-fluorophenyl)pyrazolidin-3-ylidene]-6-chloro-4-phenyl-carbostyril Formula: C35H29ClFN3O2 MolecularWeight: 578.075063

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)N2C(CC(=C3C(=C4C=C(C=CC4=NC3=O)Cl)C5=CC=CC=C5)N2)C6=CC=CC=C6F

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)N2C(CC(=C3C(=C4C=C(C=CC4=NC3=O)Cl)C5=CC=CC=C5)N2)C6=CC=CC=C6F

InChI

InChI=1S/C35H29ClFN3O2/c1-35(2,3)23-15-13-22(14-16-23)34(42)40-30(25-11-7-8-12-27(25)37)20-29(39-40)32-31(21-9-5-4-6-10-21)26-19-24(36)17-18-28(26)38-33(32)41/h4-19,30,39H,20H2,1-3H3