N-(oxolan-2-ylmethyl)-2-[2-phenyl-8-(trifluoromethyl)quinazolin-4-yl]sulfanyl-ethanamide

Systemtic Name: N-(oxolan-2-ylmethyl)-2-[2-phenyl-8-(trifluoromethyl)quinazolin-4-yl]sulfanyl-ethanamide Openeye Name: 2-[2-phenyl-8-(trifluoromethyl)quinazolin-4-yl]sulfanyl-N-(tetrahydrofuran-2-ylmethyl)acetamide CAS Name: N-(2-oxolanylmethyl)-2-[[2-phenyl-8-(trifluoromethyl)-4-quinazolinyl]thio]acetamide IUPAC Name: N-(oxolan-2-ylmethyl)-2-[2-phenyl-8-(trifluoromethyl)quinazolin-4-yl]sulfanylacetamide Traditional Name: 2-[[2-phenyl-8-(trifluoromethyl)quinazolin-4-yl]thio]-N-(tetrahydrofurfuryl)acetamide Formula: C22H20F3N3O2S MolecularWeight: 447.47331

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=O)CSC2=NC(=NC3=C2C=CC=C3C(F)(F)F)C4=CC=CC=C4

Isomeric SMILES

C1CC(OC1)CNC(=O)CSC2=NC(=NC3=C2C=CC=C3C(F)(F)F)C4=CC=CC=C4

InChI

InChI=1S/C22H20F3N3O2S/c23-22(24,25)17-10-4-9-16-19(17)27-20(14-6-2-1-3-7-14)28-21(16)31-13-18(29)26-12-15-8-5-11-30-15/h1-4,6-7,9-10,15H,5,8,11-13H2,(H,26,29)