2-(6,8-dimethyl-4-oxidanylidene-1H-quinazolin-2-yl)ethanenitrile

Systemtic Name: 2-(6,8-dimethyl-4-oxidanylidene-1H-quinazolin-2-yl)ethanenitrile Openeye Name: 2-(6,8-dimethyl-4-oxo-1H-quinazolin-2-yl)acetonitrile CAS Name: 2-(6,8-dimethyl-4-oxo-1H-quinazolin-2-yl)acetonitrile IUPAC Name: 2-(6,8-dimethyl-4-oxo-1H-quinazolin-2-yl)acetonitrile Traditional Name: 2-(4-keto-6,8-dimethyl-1H-quinazolin-2-yl)acetonitrile Formula: C12H11N3O MolecularWeight: 213.23524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=O)N=C(N2)CC#N)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=O)N=C(N2)CC#N)C

InChI

InChI=1S/C12H11N3O/c1-7-5-8(2)11-9(6-7)12(16)15-10(14-11)3-4-13/h5-6H,3H2,1-2H3,(H,14,15,16)