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

Systemtic Name: N-(2-methoxyethyl)-2-[2-phenyl-8-(trifluoromethyl)quinazolin-4-yl]sulfanyl-ethanamide Openeye Name: N-(2-methoxyethyl)-2-[2-phenyl-8-(trifluoromethyl)quinazolin-4-yl]sulfanyl-acetamide CAS Name: N-(2-methoxyethyl)-2-[[2-phenyl-8-(trifluoromethyl)-4-quinazolinyl]thio]acetamide IUPAC Name: N-(2-methoxyethyl)-2-[2-phenyl-8-(trifluoromethyl)quinazolin-4-yl]sulfanylacetamide Traditional Name: N-(2-methoxyethyl)-2-[[2-phenyl-8-(trifluoromethyl)quinazolin-4-yl]thio]acetamide Formula: C20H18F3N3O2S MolecularWeight: 421.43603

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H18F3N3O2S/c1-28-11-10-24-16(27)12-29-19-14-8-5-9-15(20(21,22)23)17(14)25-18(26-19)13-6-3-2-4-7-13/h2-9H,10-12H2,1H3,(H,24,27)