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

Systemtic Name: 4-(3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanylbutanenitrile Openeye Name: 4-(3-ethyl-4-oxo-quinazolin-2-yl)sulfanylbutanenitrile CAS Name: 4-[(3-ethyl-4-oxo-2-quinazolinyl)thio]butanenitrile IUPAC Name: 4-(3-ethyl-4-oxoquinazolin-2-yl)sulfanylbutanenitrile Traditional Name: 4-[(3-ethyl-4-keto-quinazolin-2-yl)thio]butyronitrile Formula: C14H15N3OS MolecularWeight: 273.3534

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2N=C1SCCCC#N

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2N=C1SCCCC#N

InChI

InChI=1S/C14H15N3OS/c1-2-17-13(18)11-7-3-4-8-12(11)16-14(17)19-10-6-5-9-15/h3-4,7-8H,2,5-6,10H2,1H3