N-(2,5-dimethylphenyl)-2-phenyl-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-ethanamide

Systemtic Name: N-(2,5-dimethylphenyl)-2-phenyl-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-ethanamide Openeye Name: N-(2,5-dimethylphenyl)-2-phenyl-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-acetamide CAS Name: N-(2,5-dimethylphenyl)-2-phenyl-2-[[2-(trifluoromethyl)-4-quinazolinyl]thio]acetamide IUPAC Name: N-(2,5-dimethylphenyl)-2-phenyl-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanylacetamide Traditional Name: N-(2,5-dimethylphenyl)-2-phenyl-2-[[2-(trifluoromethyl)quinazolin-4-yl]thio]acetamide Formula: C25H20F3N3OS MolecularWeight: 467.50601

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)C(C2=CC=CC=C2)SC3=NC(=NC4=CC=CC=C43)C(F)(F)F

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)C(C2=CC=CC=C2)SC3=NC(=NC4=CC=CC=C43)C(F)(F)F

InChI

InChI=1S/C25H20F3N3OS/c1-15-12-13-16(2)20(14-15)29-22(32)21(17-8-4-3-5-9-17)33-23-18-10-6-7-11-19(18)30-24(31-23)25(26,27)28/h3-14,21H,1-2H3,(H,29,32)