N-(4-bromanyl-2-fluoranyl-phenyl)-2-(7-chloranyl-4-oxidanylidene-3-propyl-quinazolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(4-bromanyl-2-fluoranyl-phenyl)-2-(7-chloranyl-4-oxidanylidene-3-propyl-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(4-bromo-2-fluoro-phenyl)-2-(7-chloro-4-oxo-3-propyl-quinazolin-2-yl)sulfanyl-acetamide CAS Name: N-(4-bromo-2-fluorophenyl)-2-[(7-chloro-4-oxo-3-propyl-2-quinazolinyl)thio]acetamide IUPAC Name: N-(4-bromo-2-fluorophenyl)-2-(7-chloro-4-oxo-3-propylquinazolin-2-yl)sulfanylacetamide Traditional Name: N-(4-bromo-2-fluoro-phenyl)-2-[(7-chloro-4-keto-3-propyl-quinazolin-2-yl)thio]acetamide Formula: C19H16BrClFN3O2S MolecularWeight: 484.769643

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H16BrClFN3O2S/c1-2-7-25-18(27)13-5-4-12(21)9-16(13)24-19(25)28-10-17(26)23-15-6-3-11(20)8-14(15)22/h3-6,8-9H,2,7,10H2,1H3,(H,23,26)