2-(6-bromanyl-4-oxidanylidene-3-propyl-quinazolin-2-yl)sulfanyl-N-(2-chloranyl-4-fluoranyl-phenyl)propanamide

Systemtic Name: 2-(6-bromanyl-4-oxidanylidene-3-propyl-quinazolin-2-yl)sulfanyl-N-(2-chloranyl-4-fluoranyl-phenyl)propanamide Openeye Name: 2-(6-bromo-4-oxo-3-propyl-quinazolin-2-yl)sulfanyl-N-(2-chloro-4-fluoro-phenyl)propanamide CAS Name: 2-[(6-bromo-4-oxo-3-propyl-2-quinazolinyl)thio]-N-(2-chloro-4-fluorophenyl)propanamide IUPAC Name: 2-(6-bromo-4-oxo-3-propylquinazolin-2-yl)sulfanyl-N-(2-chloro-4-fluorophenyl)propanamide Traditional Name: 2-[(6-bromo-4-keto-3-propyl-quinazolin-2-yl)thio]-N-(2-chloro-4-fluoro-phenyl)propionamide Formula: C20H18BrClFN3O2S MolecularWeight: 498.796223

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SC(C)C(=O)NC3=C(C=C(C=C3)F)Cl

Isomeric SMILES

CCCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SC(C)C(=O)NC3=C(C=C(C=C3)F)Cl

InChI

InChI=1S/C20H18BrClFN3O2S/c1-3-8-26-19(28)14-9-12(21)4-6-16(14)25-20(26)29-11(2)18(27)24-17-7-5-13(23)10-15(17)22/h4-7,9-11H,3,8H2,1-2H3,(H,24,27)