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

Systemtic Name: 2-[3-[2,4-bis(fluoranyl)phenyl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-cyclooctyl-ethanamide Openeye Name: N-cyclooctyl-2-[3-(2,4-difluorophenyl)-4-oxo-quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-cyclooctyl-2-[[3-(2,4-difluorophenyl)-4-oxo-2-quinazolinyl]thio]acetamide IUPAC Name: N-cyclooctyl-2-[3-(2,4-difluorophenyl)-4-oxoquinazolin-2-yl]sulfanylacetamide Traditional Name: N-cyclooctyl-2-[[3-(2,4-difluorophenyl)-4-keto-quinazolin-2-yl]thio]acetamide Formula: C24H25F2N3O2S MolecularWeight: 457.536006

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=C(C=C(C=C4)F)F

Isomeric SMILES

C1CCCC(CCC1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=C(C=C(C=C4)F)F

InChI

InChI=1S/C24H25F2N3O2S/c25-16-12-13-21(19(26)14-16)29-23(31)18-10-6-7-11-20(18)28-24(29)32-15-22(30)27-17-8-4-2-1-3-5-9-17/h6-7,10-14,17H,1-5,8-9,15H2,(H,27,30)