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

Systemtic Name: 4-(6-bromanyl-3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanylbutanenitrile Openeye Name: 4-(6-bromo-3-ethyl-4-oxo-quinazolin-2-yl)sulfanylbutanenitrile CAS Name: 4-[(6-bromo-3-ethyl-4-oxo-2-quinazolinyl)thio]butanenitrile IUPAC Name: 4-(6-bromo-3-ethyl-4-oxoquinazolin-2-yl)sulfanylbutanenitrile Traditional Name: 4-[(6-bromo-3-ethyl-4-keto-quinazolin-2-yl)thio]butyronitrile Formula: C14H14BrN3OS MolecularWeight: 352.24946

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SCCCC#N

Isomeric SMILES

CCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SCCCC#N

InChI

InChI=1S/C14H14BrN3OS/c1-2-18-13(19)11-9-10(15)5-6-12(11)17-14(18)20-8-4-3-7-16/h5-6,9H,2-4,8H2,1H3