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

Systemtic Name: (2R)-2-(7-chloranyl-4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanylpropanenitrile Openeye Name: (2R)-2-(3-allyl-7-chloro-4-oxo-quinazolin-2-yl)sulfanylpropanenitrile CAS Name: (2R)-2-[(7-chloro-4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]propanenitrile IUPAC Name: (2R)-2-(7-chloro-4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanylpropanenitrile Traditional Name: (2R)-2-[(3-allyl-7-chloro-4-keto-quinazolin-2-yl)thio]propionitrile Formula: C14H12ClN3OS MolecularWeight: 305.78258

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)SC1=NC2=C(C=CC(=C2)Cl)C(=O)N1CC=C

Isomeric SMILES

C[C@H](C#N)SC1=NC2=C(C=CC(=C2)Cl)C(=O)N1CC=C

InChI

InChI=1S/C14H12ClN3OS/c1-3-6-18-13(19)11-5-4-10(15)7-12(11)17-14(18)20-9(2)8-16/h3-5,7,9H,1,6H2,2H3/t9-/m1/s1