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

Systemtic Name: 1-(3-azanyl-2-oxidanyl-propyl)-N-[3-fluoranyl-4-(7-methoxyquinolin-4-yl)oxy-phenyl]-5-methyl-3-oxidanylidene-2-phenyl-pyrazole-4-carboxamide Openeye Name: 1-(3-amino-2-hydroxy-propyl)-N-[3-fluoro-4-[(7-methoxy-4-quinolyl)oxy]phenyl]-5-methyl-3-oxo-2-phenyl-pyrazole-4-carboxamide CAS Name: 1-(3-amino-2-hydroxypropyl)-N-[3-fluoro-4-[(7-methoxy-4-quinolinyl)oxy]phenyl]-5-methyl-3-oxo-2-phenyl-4-pyrazolecarboxamide IUPAC Name: 1-(3-amino-2-hydroxypropyl)-N-[3-fluoro-4-(7-methoxyquinolin-4-yl)oxyphenyl]-5-methyl-3-oxo-2-phenylpyrazole-4-carboxamide Traditional Name: 1-(3-amino-2-hydroxy-propyl)-N-[3-fluoro-4-[(7-methoxy-4-quinolyl)oxy]phenyl]-3-keto-5-methyl-2-phenyl-3-pyrazoline-4-carboxamide Formula: C30H28FN5O5 MolecularWeight: 557.572223

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1CC(CN)O)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(N1CC(CN)O)C2=CC=CC=C2)C(=O)NC3=CC(=C(C=C3)OC4=C5C=CC(=CC5=NC=C4)OC)F

InChI

InChI=1S/C30H28FN5O5/c1-18-28(30(39)36(20-6-4-3-5-7-20)35(18)17-21(37)16-32)29(38)34-19-8-11-27(24(31)14-19)41-26-12-13-33-25-15-22(40-2)9-10-23(25)26/h3-15,21,37H,16-17,32H2,1-2H3,(H,34,38)