2-(3-methoxy-4-oxidanylidene-quinazolin-2-yl)sulfanylpropanenitrile

Systemtic Name: 2-(3-methoxy-4-oxidanylidene-quinazolin-2-yl)sulfanylpropanenitrile Openeye Name: 2-(3-methoxy-4-oxo-quinazolin-2-yl)sulfanylpropanenitrile CAS Name: 2-[(3-methoxy-4-oxo-2-quinazolinyl)thio]propanenitrile IUPAC Name: 2-(3-methoxy-4-oxoquinazolin-2-yl)sulfanylpropanenitrile Traditional Name: 2-[(4-keto-3-methoxy-quinazolin-2-yl)thio]propionitrile Formula: C12H11N3O2S MolecularWeight: 261.29964

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)SC1=NC2=CC=CC=C2C(=O)N1OC

Isomeric SMILES

CC(C#N)SC1=NC2=CC=CC=C2C(=O)N1OC

InChI

InChI=1S/C12H11N3O2S/c1-8(7-13)18-12-14-10-6-4-3-5-9(10)11(16)15(12)17-2/h3-6,8H,1-2H3