2-(3-azanyl-1,2-benzoxazol-5-yl)-N-(2-fluoranyl-4-morpholin-4-yl-phenyl)-5-(trifluoromethyl)pyrazole-3-carboxamide

Systemtic Name: 2-(3-azanyl-1,2-benzoxazol-5-yl)-N-(2-fluoranyl-4-morpholin-4-yl-phenyl)-5-(trifluoromethyl)pyrazole-3-carboxamide Openeye Name: 2-(3-amino-1,2-benzoxazol-5-yl)-N-(2-fluoro-4-morpholino-phenyl)-5-(trifluoromethyl)pyrazole-3-carboxamide CAS Name: 2-(3-amino-1,2-benzoxazol-5-yl)-N-[2-fluoro-4-(4-morpholinyl)phenyl]-5-(trifluoromethyl)-3-pyrazolecarboxamide IUPAC Name: 2-(3-amino-1,2-benzoxazol-5-yl)-N-(2-fluoro-4-morpholin-4-ylphenyl)-5-(trifluoromethyl)pyrazole-3-carboxamide Traditional Name: 2-(3-aminoindoxazen-5-yl)-N-(2-fluoro-4-morpholino-phenyl)-5-(trifluoromethyl)pyrazole-3-carboxamide Formula: C22H18F4N6O3 MolecularWeight: 490.410333

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC(=C(C=C2)NC(=O)C3=CC(=NN3C4=CC5=C(C=C4)ON=C5N)C(F)(F)F)F

Isomeric SMILES

C1COCCN1C2=CC(=C(C=C2)NC(=O)C3=CC(=NN3C4=CC5=C(C=C4)ON=C5N)C(F)(F)F)F

InChI

InChI=1S/C22H18F4N6O3/c23-15-10-12(31-5-7-34-8-6-31)1-3-16(15)28-21(33)17-11-19(22(24,25)26)29-32(17)13-2-4-18-14(9-13)20(27)30-35-18/h1-4,9-11H,5-8H2,(H2,27,30)(H,28,33)