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

Systemtic Name: (E)-2-(6-bromanyl-4-oxidanylidene-1H-quinazolin-2-yl)-3-phenyl-prop-2-enenitrile Openeye Name: (E)-2-(6-bromo-4-oxo-1H-quinazolin-2-yl)-3-phenyl-prop-2-enenitrile CAS Name: (E)-2-(6-bromo-4-oxo-1H-quinazolin-2-yl)-3-phenyl-2-propenenitrile IUPAC Name: (E)-2-(6-bromo-4-oxo-1H-quinazolin-2-yl)-3-phenylprop-2-enenitrile Traditional Name: (E)-2-(6-bromo-4-keto-1H-quinazolin-2-yl)-3-phenyl-acrylonitrile Formula: C17H10BrN3O MolecularWeight: 352.1848

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H10BrN3O/c18-13-6-7-15-14(9-13)17(22)21-16(20-15)12(10-19)8-11-4-2-1-3-5-11/h1-9H,(H,20,21,22)/b12-8+