2-(6-bromanyl-4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanyl-N-(prop-2-enylcarbamoyl)ethanamide

Systemtic Name: 2-(6-bromanyl-4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanyl-N-(prop-2-enylcarbamoyl)ethanamide Openeye Name: N-(allylcarbamoyl)-2-(6-bromo-4-oxo-3-phenyl-quinazolin-2-yl)sulfanyl-acetamide CAS Name: 2-[(6-bromo-4-oxo-3-phenyl-2-quinazolinyl)thio]-N-[oxo-(prop-2-enylamino)methyl]acetamide IUPAC Name: 2-(6-bromo-4-oxo-3-phenylquinazolin-2-yl)sulfanyl-N-(prop-2-enylcarbamoyl)acetamide Traditional Name: N-(allylcarbamoyl)-2-[(6-bromo-4-keto-3-phenyl-quinazolin-2-yl)thio]acetamide Formula: C20H17BrN4O3S MolecularWeight: 473.34298

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)NC(=O)CSC1=NC2=C(C=C(C=C2)Br)C(=O)N1C3=CC=CC=C3

Isomeric SMILES

C=CCNC(=O)NC(=O)CSC1=NC2=C(C=C(C=C2)Br)C(=O)N1C3=CC=CC=C3

InChI

InChI=1S/C20H17BrN4O3S/c1-2-10-22-19(28)24-17(26)12-29-20-23-16-9-8-13(21)11-15(16)18(27)25(20)14-6-4-3-5-7-14/h2-9,11H,1,10,12H2,(H2,22,24,26,28)