3-(2-propan-2-ylphenyl)-2-[3,3,3-tris(fluoranyl)-2-oxidanylidene-propyl]sulfanyl-quinazolin-4-one

Systemtic Name: 3-(2-propan-2-ylphenyl)-2-[3,3,3-tris(fluoranyl)-2-oxidanylidene-propyl]sulfanyl-quinazolin-4-one Openeye Name: 3-(2-isopropylphenyl)-2-(3,3,3-trifluoro-2-oxo-propyl)sulfanyl-quinazolin-4-one CAS Name: 3-(2-propan-2-ylphenyl)-2-[(3,3,3-trifluoro-2-oxopropyl)thio]-4-quinazolinone IUPAC Name: 3-(2-propan-2-ylphenyl)-2-(3,3,3-trifluoro-2-oxopropyl)sulfanylquinazolin-4-one Traditional Name: 3-o-cumenyl-2-[(3,3,3-trifluoro-2-keto-propyl)thio]quinazolin-4-one Formula: C20H17F3N2O2S MolecularWeight: 406.42139

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H17F3N2O2S/c1-12(2)13-7-4-6-10-16(13)25-18(27)14-8-3-5-9-15(14)24-19(25)28-11-17(26)20(21,22)23/h3-10,12H,11H2,1-2H3