N-tert-butyl-2-[2-phenyl-8-(trifluoromethyl)quinazolin-4-yl]sulfanyl-ethanamide

Systemtic Name: N-tert-butyl-2-[2-phenyl-8-(trifluoromethyl)quinazolin-4-yl]sulfanyl-ethanamide Openeye Name: N-tert-butyl-2-[2-phenyl-8-(trifluoromethyl)quinazolin-4-yl]sulfanyl-acetamide CAS Name: N-tert-butyl-2-[[2-phenyl-8-(trifluoromethyl)-4-quinazolinyl]thio]acetamide IUPAC Name: N-tert-butyl-2-[2-phenyl-8-(trifluoromethyl)quinazolin-4-yl]sulfanylacetamide Traditional Name: N-tert-butyl-2-[[2-phenyl-8-(trifluoromethyl)quinazolin-4-yl]thio]acetamide Formula: C21H20F3N3OS MolecularWeight: 419.46321

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CSC1=NC(=NC2=C1C=CC=C2C(F)(F)F)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)NC(=O)CSC1=NC(=NC2=C1C=CC=C2C(F)(F)F)C3=CC=CC=C3

InChI

InChI=1S/C21H20F3N3OS/c1-20(2,3)27-16(28)12-29-19-14-10-7-11-15(21(22,23)24)17(14)25-18(26-19)13-8-5-4-6-9-13/h4-11H,12H2,1-3H3,(H,27,28)