N-[2-[4-[2-[2-(2,2-dimethylpropanoylamino)phenyl]-3-fluoranyl-quinolin-4-yl]carbonyl-3-fluoranyl-quinolin-2-yl]phenyl]-2,2-dimethyl-propanamide

Systemtic Name: N-[2-[4-[2-[2-(2,2-dimethylpropanoylamino)phenyl]-3-fluoranyl-quinolin-4-yl]carbonyl-3-fluoranyl-quinolin-2-yl]phenyl]-2,2-dimethyl-propanamide Openeye Name: N-[2-[4-[2-[2-(2,2-dimethylpropanoylamino)phenyl]-3-fluoro-quinoline-4-carbonyl]-3-fluoro-2-quinolyl]phenyl]-2,2-dimethyl-propanamide CAS Name: N-[2-[4-[[2-[2-[(2,2-dimethyl-1-oxopropyl)amino]phenyl]-3-fluoro-4-quinolinyl]-oxomethyl]-3-fluoro-2-quinolinyl]phenyl]-2,2-dimethylpropanamide IUPAC Name: N-[2-[4-[2-[2-(2,2-dimethylpropanoylamino)phenyl]-3-fluoroquinoline-4-carbonyl]-3-fluoroquinolin-2-yl]phenyl]-2,2-dimethylpropanamide Traditional Name: N-[2-[3-fluoro-4-[3-fluoro-2-[2-(pivaloylamino)phenyl]quinoline-4-carbonyl]-2-quinolyl]phenyl]-2,2-dimethyl-propionamide Formula: C41H36F2N4O3 MolecularWeight: 670.746346

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=CC=CC=C1C2=NC3=CC=CC=C3C(=C2F)C(=O)C4=C(C(=NC5=CC=CC=C54)C6=CC=CC=C6NC(=O)C(C)(C)C)F

Isomeric SMILES

CC(C)(C)C(=O)NC1=CC=CC=C1C2=NC3=CC=CC=C3C(=C2F)C(=O)C4=C(C(=NC5=CC=CC=C54)C6=CC=CC=C6NC(=O)C(C)(C)C)F

InChI

InChI=1S/C41H36F2N4O3/c1-40(2,3)38(49)46-29-21-13-9-17-25(29)35-33(42)31(23-15-7-11-19-27(23)44-35)37(48)32-24-16-8-12-20-28(24)45-36(34(32)43)26-18-10-14-22-30(26)47-39(50)41(4,5)6/h7-22H,1-6H3,(H,46,49)(H,47,50)