(E)-2-(6-bromanyl-4-oxidanylidene-1H-quinazolin-2-yl)-3-(4-dimethylaminophenyl)prop-2-enenitrile

Systemtic Name: (E)-2-(6-bromanyl-4-oxidanylidene-1H-quinazolin-2-yl)-3-(4-dimethylaminophenyl)prop-2-enenitrile Openeye Name: (E)-2-(6-bromo-4-oxo-1H-quinazolin-2-yl)-3-(4-dimethylaminophenyl)prop-2-enenitrile CAS Name: (E)-2-(6-bromo-4-oxo-1H-quinazolin-2-yl)-3-(4-dimethylaminophenyl)-2-propenenitrile IUPAC Name: (E)-2-(6-bromo-4-oxo-1H-quinazolin-2-yl)-3-(4-dimethylaminophenyl)prop-2-enenitrile Traditional Name: (E)-2-(6-bromo-4-keto-1H-quinazolin-2-yl)-3-(4-dimethylaminophenyl)acrylonitrile Formula: C19H15BrN4O MolecularWeight: 395.2526

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C=C(C#N)C2=NC(=O)C3=C(N2)C=CC(=C3)Br

Isomeric SMILES

CN(C)C1=CC=C(C=C1)/C=C(\C#N)/C2=NC(=O)C3=C(N2)C=CC(=C3)Br

InChI

InChI=1S/C19H15BrN4O/c1-24(2)15-6-3-12(4-7-15)9-13(11-21)18-22-17-8-5-14(20)10-16(17)19(25)23-18/h3-10H,1-2H3,(H,22,23,25)/b13-9+