(E)-3-(3-bromanyl-4-fluoranyl-phenyl)-2-(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)prop-2-enenitrile

Systemtic Name: (E)-3-(3-bromanyl-4-fluoranyl-phenyl)-2-(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)prop-2-enenitrile Openeye Name: (E)-3-(3-bromo-4-fluoro-phenyl)-2-(7-chloro-4-oxo-1H-quinazolin-2-yl)prop-2-enenitrile CAS Name: (E)-3-(3-bromo-4-fluorophenyl)-2-(7-chloro-4-oxo-1H-quinazolin-2-yl)-2-propenenitrile IUPAC Name: (E)-3-(3-bromo-4-fluorophenyl)-2-(7-chloro-4-oxo-1H-quinazolin-2-yl)prop-2-enenitrile Traditional Name: (E)-3-(3-bromo-4-fluoro-phenyl)-2-(7-chloro-4-keto-1H-quinazolin-2-yl)acrylonitrile Formula: C17H8BrClFN3O MolecularWeight: 404.620323

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C=C(C#N)C2=NC(=O)C3=C(N2)C=C(C=C3)Cl)Br)F

Isomeric SMILES

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

InChI

InChI=1S/C17H8BrClFN3O/c18-13-6-9(1-4-14(13)20)5-10(8-21)16-22-15-7-11(19)2-3-12(15)17(24)23-16/h1-7H,(H,22,23,24)/b10-5+