2-(6-bromanyl-4-oxidanylidene-3-pentyl-quinazolin-2-yl)sulfanylpropanamide

Systemtic Name: 2-(6-bromanyl-4-oxidanylidene-3-pentyl-quinazolin-2-yl)sulfanylpropanamide Openeye Name: 2-(6-bromo-4-oxo-3-pentyl-quinazolin-2-yl)sulfanylpropanamide CAS Name: 2-[(6-bromo-4-oxo-3-pentyl-2-quinazolinyl)thio]propanamide IUPAC Name: 2-(6-bromo-4-oxo-3-pentylquinazolin-2-yl)sulfanylpropanamide Traditional Name: 2-[(3-amyl-6-bromo-4-keto-quinazolin-2-yl)thio]propionamide Formula: C16H20BrN3O2S MolecularWeight: 398.3179

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SC(C)C(=O)N

Isomeric SMILES

CCCCCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SC(C)C(=O)N

InChI

InChI=1S/C16H20BrN3O2S/c1-3-4-5-8-20-15(22)12-9-11(17)6-7-13(12)19-16(20)23-10(2)14(18)21/h6-7,9-10H,3-5,8H2,1-2H3,(H2,18,21)