N-(3-ethoxypropyl)-2-[2-phenyl-8-(trifluoromethyl)quinazolin-4-yl]sulfanyl-ethanamide

Systemtic Name: N-(3-ethoxypropyl)-2-[2-phenyl-8-(trifluoromethyl)quinazolin-4-yl]sulfanyl-ethanamide Openeye Name: N-(3-ethoxypropyl)-2-[2-phenyl-8-(trifluoromethyl)quinazolin-4-yl]sulfanyl-acetamide CAS Name: N-(3-ethoxypropyl)-2-[[2-phenyl-8-(trifluoromethyl)-4-quinazolinyl]thio]acetamide IUPAC Name: N-(3-ethoxypropyl)-2-[2-phenyl-8-(trifluoromethyl)quinazolin-4-yl]sulfanylacetamide Traditional Name: N-(3-ethoxypropyl)-2-[[2-phenyl-8-(trifluoromethyl)quinazolin-4-yl]thio]acetamide Formula: C22H22F3N3O2S MolecularWeight: 449.48919

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22F3N3O2S/c1-2-30-13-7-12-26-18(29)14-31-21-16-10-6-11-17(22(23,24)25)19(16)27-20(28-21)15-8-4-3-5-9-15/h3-6,8-11H,2,7,12-14H2,1H3,(H,26,29)