4-(7-chloranyl-4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanylbutanenitrile

Systemtic Name: 4-(7-chloranyl-4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanylbutanenitrile Openeye Name: 4-(3-allyl-7-chloro-4-oxo-quinazolin-2-yl)sulfanylbutanenitrile CAS Name: 4-[(7-chloro-4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]butanenitrile IUPAC Name: 4-(7-chloro-4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanylbutanenitrile Traditional Name: 4-[(3-allyl-7-chloro-4-keto-quinazolin-2-yl)thio]butyronitrile Formula: C15H14ClN3OS MolecularWeight: 319.80916

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCCCC#N

Isomeric SMILES

C=CCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCCCC#N

InChI

InChI=1S/C15H14ClN3OS/c1-2-8-19-14(20)12-6-5-11(16)10-13(12)18-15(19)21-9-4-3-7-17/h2,5-6,10H,1,3-4,8-9H2