N-(2-cyanophenyl)-2-[4-oxidanylidene-3-[2-(trifluoromethyl)phenyl]quinazolin-2-yl]sulfanyl-propanamide

Systemtic Name: N-(2-cyanophenyl)-2-[4-oxidanylidene-3-[2-(trifluoromethyl)phenyl]quinazolin-2-yl]sulfanyl-propanamide Openeye Name: N-(2-cyanophenyl)-2-[4-oxo-3-[2-(trifluoromethyl)phenyl]quinazolin-2-yl]sulfanyl-propanamide CAS Name: N-(2-cyanophenyl)-2-[[4-oxo-3-[2-(trifluoromethyl)phenyl]-2-quinazolinyl]thio]propanamide IUPAC Name: N-(2-cyanophenyl)-2-[4-oxo-3-[2-(trifluoromethyl)phenyl]quinazolin-2-yl]sulfanylpropanamide Traditional Name: N-(2-cyanophenyl)-2-[[4-keto-3-[2-(trifluoromethyl)phenyl]quinazolin-2-yl]thio]propionamide Formula: C25H17F3N4O2S MolecularWeight: 494.48829

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1C#N)SC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4C(F)(F)F

Isomeric SMILES

CC(C(=O)NC1=CC=CC=C1C#N)SC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4C(F)(F)F

InChI

InChI=1S/C25H17F3N4O2S/c1-15(22(33)30-19-11-5-2-8-16(19)14-29)35-24-31-20-12-6-3-9-17(20)23(34)32(24)21-13-7-4-10-18(21)25(26,27)28/h2-13,15H,1H3,(H,30,33)