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

Systemtic Name: 3-(6-bromanyl-3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanylpropanenitrile Openeye Name: 3-(6-bromo-3-ethyl-4-oxo-quinazolin-2-yl)sulfanylpropanenitrile CAS Name: 3-[(6-bromo-3-ethyl-4-oxo-2-quinazolinyl)thio]propanenitrile IUPAC Name: 3-(6-bromo-3-ethyl-4-oxoquinazolin-2-yl)sulfanylpropanenitrile Traditional Name: 3-[(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=C1SCCC#N

Isomeric SMILES

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

InChI

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