N-[2,5-bis(fluoranyl)phenyl]-2-(6-bromanyl-4-oxidanylidene-3-propyl-quinazolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[2,5-bis(fluoranyl)phenyl]-2-(6-bromanyl-4-oxidanylidene-3-propyl-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: 2-(6-bromo-4-oxo-3-propyl-quinazolin-2-yl)sulfanyl-N-(2,5-difluorophenyl)acetamide CAS Name: 2-[(6-bromo-4-oxo-3-propyl-2-quinazolinyl)thio]-N-(2,5-difluorophenyl)acetamide IUPAC Name: 2-(6-bromo-4-oxo-3-propylquinazolin-2-yl)sulfanyl-N-(2,5-difluorophenyl)acetamide Traditional Name: 2-[(6-bromo-4-keto-3-propyl-quinazolin-2-yl)thio]-N-(2,5-difluorophenyl)acetamide Formula: C19H16BrF2N3O2S MolecularWeight: 468.315046

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SCC(=O)NC3=C(C=CC(=C3)F)F

Isomeric SMILES

CCCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SCC(=O)NC3=C(C=CC(=C3)F)F

InChI

InChI=1S/C19H16BrF2N3O2S/c1-2-7-25-18(27)13-8-11(20)3-6-15(13)24-19(25)28-10-17(26)23-16-9-12(21)4-5-14(16)22/h3-6,8-9H,2,7,10H2,1H3,(H,23,26)