2-(6-fluoranyl-4-oxidanylidene-quinazolin-3-yl)-N-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]ethanamide

Systemtic Name: 2-(6-fluoranyl-4-oxidanylidene-quinazolin-3-yl)-N-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]ethanamide Openeye Name: 2-(6-fluoro-4-oxo-quinazolin-3-yl)-N-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]acetamide CAS Name: 2-(6-fluoro-4-oxo-3-quinazolinyl)-N-[2-(1-pyrazolyl)-5-(trifluoromethyl)phenyl]acetamide IUPAC Name: 2-(6-fluoro-4-oxoquinazolin-3-yl)-N-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]acetamide Traditional Name: 2-(6-fluoro-4-keto-quinazolin-3-yl)-N-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]acetamide Formula: C20H13F4N5O2 MolecularWeight: 431.343133

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(N=C1)C2=C(C=C(C=C2)C(F)(F)F)NC(=O)CN3C=NC4=C(C3=O)C=C(C=C4)F

Isomeric SMILES

C1=CN(N=C1)C2=C(C=C(C=C2)C(F)(F)F)NC(=O)CN3C=NC4=C(C3=O)C=C(C=C4)F

InChI

InChI=1S/C20H13F4N5O2/c21-13-3-4-15-14(9-13)19(31)28(11-25-15)10-18(30)27-16-8-12(20(22,23)24)2-5-17(16)29-7-1-6-26-29/h1-9,11H,10H2,(H,27,30)