1-(2-azanylethyl)-N-[3-fluoranyl-4-(7-methoxyquinolin-4-yl)oxy-phenyl]-5-methyl-3-oxidanylidene-2-phenyl-pyrazole-4-carboxamide

Systemtic Name: 1-(2-azanylethyl)-N-[3-fluoranyl-4-(7-methoxyquinolin-4-yl)oxy-phenyl]-5-methyl-3-oxidanylidene-2-phenyl-pyrazole-4-carboxamide Openeye Name: 1-(2-aminoethyl)-N-[3-fluoro-4-[(7-methoxy-4-quinolyl)oxy]phenyl]-5-methyl-3-oxo-2-phenyl-pyrazole-4-carboxamide CAS Name: 1-(2-aminoethyl)-N-[3-fluoro-4-[(7-methoxy-4-quinolinyl)oxy]phenyl]-5-methyl-3-oxo-2-phenyl-4-pyrazolecarboxamide IUPAC Name: 1-(2-aminoethyl)-N-[3-fluoro-4-(7-methoxyquinolin-4-yl)oxyphenyl]-5-methyl-3-oxo-2-phenylpyrazole-4-carboxamide Traditional Name: 1-(2-aminoethyl)-N-[3-fluoro-4-[(7-methoxy-4-quinolyl)oxy]phenyl]-3-keto-5-methyl-2-phenyl-3-pyrazoline-4-carboxamide Formula: C29H26FN5O4 MolecularWeight: 527.546243

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1CCN)C2=CC=CC=C2)C(=O)NC3=CC(=C(C=C3)OC4=C5C=CC(=CC5=NC=C4)OC)F

Isomeric SMILES

CC1=C(C(=O)N(N1CCN)C2=CC=CC=C2)C(=O)NC3=CC(=C(C=C3)OC4=C5C=CC(=CC5=NC=C4)OC)F

InChI

InChI=1S/C29H26FN5O4/c1-18-27(29(37)35(34(18)15-13-31)20-6-4-3-5-7-20)28(36)33-19-8-11-26(23(30)16-19)39-25-12-14-32-24-17-21(38-2)9-10-22(24)25/h3-12,14,16-17H,13,15,31H2,1-2H3,(H,33,36)