6-[4-oxidanylidene-3-[3-(trifluoromethyl)phenyl]quinazolin-2-yl]sulfanyl-N-(1-phenylethyl)hexanamide

Systemtic Name: 6-[4-oxidanylidene-3-[3-(trifluoromethyl)phenyl]quinazolin-2-yl]sulfanyl-N-(1-phenylethyl)hexanamide Openeye Name: 6-[4-oxo-3-[3-(trifluoromethyl)phenyl]quinazolin-2-yl]sulfanyl-N-(1-phenylethyl)hexanamide CAS Name: 6-[[4-oxo-3-[3-(trifluoromethyl)phenyl]-2-quinazolinyl]thio]-N-(1-phenylethyl)hexanamide IUPAC Name: 6-[4-oxo-3-[3-(trifluoromethyl)phenyl]quinazolin-2-yl]sulfanyl-N-(1-phenylethyl)hexanamide Traditional Name: 6-[[4-keto-3-[3-(trifluoromethyl)phenyl]quinazolin-2-yl]thio]-N-(1-phenylethyl)hexanamide Formula: C29H28F3N3O2S MolecularWeight: 539.61173

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)CCCCCSC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

CC(C1=CC=CC=C1)NC(=O)CCCCCSC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C29H28F3N3O2S/c1-20(21-11-4-2-5-12-21)33-26(36)17-6-3-9-18-38-28-34-25-16-8-7-15-24(25)27(37)35(28)23-14-10-13-22(19-23)29(30,31)32/h2,4-5,7-8,10-16,19-20H,3,6,9,17-18H2,1H3,(H,33,36)