2-[4-oxidanylidene-3-(2-propan-2-ylphenyl)quinazolin-2-yl]sulfanyl-N-[2-(trifluoromethyl)phenyl]ethanamide

Systemtic Name: 2-[4-oxidanylidene-3-(2-propan-2-ylphenyl)quinazolin-2-yl]sulfanyl-N-[2-(trifluoromethyl)phenyl]ethanamide Openeye Name: 2-[3-(2-isopropylphenyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-[2-(trifluoromethyl)phenyl]acetamide CAS Name: 2-[[4-oxo-3-(2-propan-2-ylphenyl)-2-quinazolinyl]thio]-N-[2-(trifluoromethyl)phenyl]acetamide IUPAC Name: 2-[4-oxo-3-(2-propan-2-ylphenyl)quinazolin-2-yl]sulfanyl-N-[2-(trifluoromethyl)phenyl]acetamide Traditional Name: 2-[(4-keto-3-o-cumenyl-quinazolin-2-yl)thio]-N-[2-(trifluoromethyl)phenyl]acetamide Formula: C26H22F3N3O2S MolecularWeight: 497.53199

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4=CC=CC=C4C(F)(F)F

Isomeric SMILES

CC(C)C1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4=CC=CC=C4C(F)(F)F

InChI

InChI=1S/C26H22F3N3O2S/c1-16(2)17-9-4-8-14-22(17)32-24(34)18-10-3-6-12-20(18)31-25(32)35-15-23(33)30-21-13-7-5-11-19(21)26(27,28)29/h3-14,16H,15H2,1-2H3,(H,30,33)