2-[(4-oxidanylidene-1H-quinazolin-2-yl)sulfanyl]-3-[3-(trifluoromethyl)phenyl]quinazolin-4-one

Systemtic Name: 2-[(4-oxidanylidene-1H-quinazolin-2-yl)sulfanyl]-3-[3-(trifluoromethyl)phenyl]quinazolin-4-one Openeye Name: 2-[(4-oxo-1H-quinazolin-2-yl)sulfanyl]-3-[3-(trifluoromethyl)phenyl]quinazolin-4-one CAS Name: 2-[(4-oxo-1H-quinazolin-2-yl)thio]-3-[3-(trifluoromethyl)phenyl]-4-quinazolinone IUPAC Name: 2-[(4-oxo-1H-quinazolin-2-yl)sulfanyl]-3-[3-(trifluoromethyl)phenyl]quinazolin-4-one Traditional Name: 2-[(4-keto-1H-quinazolin-2-yl)thio]-3-[3-(trifluoromethyl)phenyl]quinazolin-4-one Formula: C23H13F3N4O2S MolecularWeight: 466.43513

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N=C(N2)SC3=NC4=CC=CC=C4C(=O)N3C5=CC=CC(=C5)C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N=C(N2)SC3=NC4=CC=CC=C4C(=O)N3C5=CC=CC(=C5)C(F)(F)F

InChI

InChI=1S/C23H13F3N4O2S/c24-23(25,26)13-6-5-7-14(12-13)30-20(32)16-9-2-4-11-18(16)28-22(30)33-21-27-17-10-3-1-8-15(17)19(31)29-21/h1-12H,(H,27,29,31)