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

Systemtic Name: N-(furan-2-ylmethyl)-4-oxidanylidene-3-[3-(trifluoromethyl)phenyl]quinazoline-7-carboxamide Openeye Name: N-(2-furylmethyl)-4-oxo-3-[3-(trifluoromethyl)phenyl]quinazoline-7-carboxamide CAS Name: N-(2-furanylmethyl)-4-oxo-3-[3-(trifluoromethyl)phenyl]-7-quinazolinecarboxamide IUPAC Name: N-(furan-2-ylmethyl)-4-oxo-3-[3-(trifluoromethyl)phenyl]quinazoline-7-carboxamide Traditional Name: N-(2-furfuryl)-4-keto-3-[3-(trifluoromethyl)phenyl]quinazoline-7-carboxamide Formula: C21H14F3N3O3 MolecularWeight: 413.34937

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)N2C=NC3=C(C2=O)C=CC(=C3)C(=O)NCC4=CC=CO4)C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)N2C=NC3=C(C2=O)C=CC(=C3)C(=O)NCC4=CC=CO4)C(F)(F)F

InChI

InChI=1S/C21H14F3N3O3/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/h1-10,12H,11H2,(H,25,28)