3-[[6-bromanyl-2-(trifluoromethyl)quinazolin-4-yl]amino]benzenecarbonitrile

Systemtic Name: 3-[[6-bromanyl-2-(trifluoromethyl)quinazolin-4-yl]amino]benzenecarbonitrile Openeye Name: 3-[[6-bromo-2-(trifluoromethyl)quinazolin-4-yl]amino]benzonitrile CAS Name: 3-[[6-bromo-2-(trifluoromethyl)-4-quinazolinyl]amino]benzonitrile IUPAC Name: 3-[[6-bromo-2-(trifluoromethyl)quinazolin-4-yl]amino]benzonitrile Traditional Name: 3-[[6-bromo-2-(trifluoromethyl)quinazolin-4-yl]amino]benzonitrile Formula: C16H8BrF3N4 MolecularWeight: 393.16073

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC2=NC(=NC3=C2C=C(C=C3)Br)C(F)(F)F)C#N

Isomeric SMILES

C1=CC(=CC(=C1)NC2=NC(=NC3=C2C=C(C=C3)Br)C(F)(F)F)C#N

InChI

InChI=1S/C16H8BrF3N4/c17-10-4-5-13-12(7-10)14(24-15(23-13)16(18,19)20)22-11-3-1-2-9(6-11)8-21/h1-7H,(H,22,23,24)