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

Systemtic Name: 2-(6-bromanyl-3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(3-chloranyl-4-cyano-phenyl)propanamide Openeye Name: 2-(6-bromo-3-ethyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(3-chloro-4-cyano-phenyl)propanamide CAS Name: 2-[(6-bromo-3-ethyl-4-oxo-2-quinazolinyl)thio]-N-(3-chloro-4-cyanophenyl)propanamide IUPAC Name: 2-(6-bromo-3-ethyl-4-oxoquinazolin-2-yl)sulfanyl-N-(3-chloro-4-cyanophenyl)propanamide Traditional Name: 2-[(6-bromo-3-ethyl-4-keto-quinazolin-2-yl)thio]-N-(3-chloro-4-cyano-phenyl)propionamide Formula: C20H16BrClN4O2S MolecularWeight: 491.78864

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SC(C)C(=O)NC3=CC(=C(C=C3)C#N)Cl

Isomeric SMILES

CCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SC(C)C(=O)NC3=CC(=C(C=C3)C#N)Cl

InChI

InChI=1S/C20H16BrClN4O2S/c1-3-26-19(28)15-8-13(21)5-7-17(15)25-20(26)29-11(2)18(27)24-14-6-4-12(10-23)16(22)9-14/h4-9,11H,3H2,1-2H3,(H,24,27)