2-(6-bromanyl-4-oxidanylidene-3-propyl-quinazolin-2-yl)sulfanyl-N-[(2S)-2-cyano-3-methyl-butan-2-yl]ethanamide

Systemtic Name: 2-(6-bromanyl-4-oxidanylidene-3-propyl-quinazolin-2-yl)sulfanyl-N-[(2S)-2-cyano-3-methyl-butan-2-yl]ethanamide Openeye Name: 2-(6-bromo-4-oxo-3-propyl-quinazolin-2-yl)sulfanyl-N-[(1S)-1-cyano-1,2-dimethyl-propyl]acetamide CAS Name: 2-[(6-bromo-4-oxo-3-propyl-2-quinazolinyl)thio]-N-[(2S)-2-cyano-3-methylbutan-2-yl]acetamide IUPAC Name: 2-(6-bromo-4-oxo-3-propylquinazolin-2-yl)sulfanyl-N-[(2S)-2-cyano-3-methylbutan-2-yl]acetamide Traditional Name: 2-[(6-bromo-4-keto-3-propyl-quinazolin-2-yl)thio]-N-[(1S)-1-cyano-1,2-dimethyl-propyl]acetamide Formula: C19H23BrN4O2S MolecularWeight: 451.38052

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SCC(=O)NC(C)(C#N)C(C)C

Isomeric SMILES

CCCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SCC(=O)N[C@](C)(C#N)C(C)C

InChI

InChI=1S/C19H23BrN4O2S/c1-5-8-24-17(26)14-9-13(20)6-7-15(14)22-18(24)27-10-16(25)23-19(4,11-21)12(2)3/h6-7,9,12H,5,8,10H2,1-4H3,(H,23,25)/t19-/m1/s1