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

Systemtic Name: 3-(6-bromanyl-3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanylpropanamide Openeye Name: 3-(6-bromo-3-ethyl-4-oxo-quinazolin-2-yl)sulfanylpropanamide CAS Name: 3-[(6-bromo-3-ethyl-4-oxo-2-quinazolinyl)thio]propanamide IUPAC Name: 3-(6-bromo-3-ethyl-4-oxoquinazolin-2-yl)sulfanylpropanamide Traditional Name: 3-[(6-bromo-3-ethyl-4-keto-quinazolin-2-yl)thio]propionamide Formula: C13H14BrN3O2S MolecularWeight: 356.23816

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SCCC(=O)N

Isomeric SMILES

CCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SCCC(=O)N

InChI

InChI=1S/C13H14BrN3O2S/c1-2-17-12(19)9-7-8(14)3-4-10(9)16-13(17)20-6-5-11(15)18/h3-4,7H,2,5-6H2,1H3,(H2,15,18)