N-[4-[bis(fluoranyl)methylsulfanyl]phenyl]-2-(3-hexyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[4-[bis(fluoranyl)methylsulfanyl]phenyl]-2-(3-hexyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: N-[4-(difluoromethylsulfanyl)phenyl]-2-(3-hexyl-4-oxo-quinazolin-2-yl)sulfanyl-acetamide CAS Name: N-[4-(difluoromethylthio)phenyl]-2-[(3-hexyl-4-oxo-2-quinazolinyl)thio]acetamide IUPAC Name: N-[4-(difluoromethylsulfanyl)phenyl]-2-(3-hexyl-4-oxoquinazolin-2-yl)sulfanylacetamide Traditional Name: N-[4-(difluoromethylthio)phenyl]-2-[(3-hexyl-4-keto-quinazolin-2-yl)thio]acetamide Formula: C23H25F2N3O2S2 MolecularWeight: 477.590306

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=CC=C(C=C3)SC(F)F

Isomeric SMILES

CCCCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=CC=C(C=C3)SC(F)F

InChI

InChI=1S/C23H25F2N3O2S2/c1-2-3-4-7-14-28-21(30)18-8-5-6-9-19(18)27-23(28)31-15-20(29)26-16-10-12-17(13-11-16)32-22(24)25/h5-6,8-13,22H,2-4,7,14-15H2,1H3,(H,26,29)