4-oxidanylidene-N-(oxolan-2-ylmethyl)-3-[3-(trifluoromethyl)phenyl]quinazoline-7-carboxamide

Systemtic Name: 4-oxidanylidene-N-(oxolan-2-ylmethyl)-3-[3-(trifluoromethyl)phenyl]quinazoline-7-carboxamide Openeye Name: 4-oxo-N-(tetrahydrofuran-2-ylmethyl)-3-[3-(trifluoromethyl)phenyl]quinazoline-7-carboxamide CAS Name: 4-oxo-N-(2-oxolanylmethyl)-3-[3-(trifluoromethyl)phenyl]-7-quinazolinecarboxamide IUPAC Name: 4-oxo-N-(oxolan-2-ylmethyl)-3-[3-(trifluoromethyl)phenyl]quinazoline-7-carboxamide Traditional Name: 4-keto-N-(tetrahydrofurfuryl)-3-[3-(trifluoromethyl)phenyl]quinazoline-7-carboxamide Formula: C21H18F3N3O3 MolecularWeight: 417.38113

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=O)C2=CC3=C(C=C2)C(=O)N(C=N3)C4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

C1CC(OC1)CNC(=O)C2=CC3=C(C=C2)C(=O)N(C=N3)C4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C21H18F3N3O3/c22-21(23,24)14-3-1-4-15(10-14)27-12-26-18-9-13(6-7-17(18)20(27)29)19(28)25-11-16-5-2-8-30-16/h1,3-4,6-7,9-10,12,16H,2,5,8,11H2,(H,25,28)