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

Systemtic Name: 3-(6-bromanyl-4-oxidanylidene-3-propyl-quinazolin-2-yl)sulfanylpropanenitrile Openeye Name: 3-(6-bromo-4-oxo-3-propyl-quinazolin-2-yl)sulfanylpropanenitrile CAS Name: 3-[(6-bromo-4-oxo-3-propyl-2-quinazolinyl)thio]propanenitrile IUPAC Name: 3-(6-bromo-4-oxo-3-propylquinazolin-2-yl)sulfanylpropanenitrile Traditional Name: 3-[(6-bromo-4-keto-3-propyl-quinazolin-2-yl)thio]propionitrile Formula: C14H14BrN3OS MolecularWeight: 352.24946

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SCCC#N

Isomeric SMILES

CCCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SCCC#N

InChI

InChI=1S/C14H14BrN3OS/c1-2-7-18-13(19)11-9-10(15)4-5-12(11)17-14(18)20-8-3-6-16/h4-5,9H,2-3,7-8H2,1H3