(E)-3-(2,4-dimethylphenyl)-2-(4-oxidanylidene-1H-quinazolin-2-yl)prop-2-enenitrile

Systemtic Name: (E)-3-(2,4-dimethylphenyl)-2-(4-oxidanylidene-1H-quinazolin-2-yl)prop-2-enenitrile Openeye Name: (E)-3-(2,4-dimethylphenyl)-2-(4-oxo-1H-quinazolin-2-yl)prop-2-enenitrile CAS Name: (E)-3-(2,4-dimethylphenyl)-2-(4-oxo-1H-quinazolin-2-yl)-2-propenenitrile IUPAC Name: (E)-3-(2,4-dimethylphenyl)-2-(4-oxo-1H-quinazolin-2-yl)prop-2-enenitrile Traditional Name: (E)-3-(2,4-dimethylphenyl)-2-(4-keto-1H-quinazolin-2-yl)acrylonitrile Formula: C19H15N3O MolecularWeight: 301.3419

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C=C(C#N)C2=NC(=O)C3=CC=CC=C3N2)C

Isomeric SMILES

CC1=CC(=C(C=C1)/C=C(\C#N)/C2=NC(=O)C3=CC=CC=C3N2)C

InChI

InChI=1S/C19H15N3O/c1-12-7-8-14(13(2)9-12)10-15(11-20)18-21-17-6-4-3-5-16(17)19(23)22-18/h3-10H,1-2H3,(H,21,22,23)/b15-10+