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

Systemtic Name: 2-(6-bromanyl-3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanylpropanenitrile Openeye Name: 2-(6-bromo-3-ethyl-4-oxo-quinazolin-2-yl)sulfanylpropanenitrile CAS Name: 2-[(6-bromo-3-ethyl-4-oxo-2-quinazolinyl)thio]propanenitrile IUPAC Name: 2-(6-bromo-3-ethyl-4-oxoquinazolin-2-yl)sulfanylpropanenitrile Traditional Name: 2-[(6-bromo-3-ethyl-4-keto-quinazolin-2-yl)thio]propionitrile Formula: C13H12BrN3OS MolecularWeight: 338.22288

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H12BrN3OS/c1-3-17-12(18)10-6-9(14)4-5-11(10)16-13(17)19-8(2)7-15/h4-6,8H,3H2,1-2H3