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

Systemtic Name: 4-[[2-(trifluoromethyl)quinazolin-4-yl]amino]benzenecarbonitrile Openeye Name: 4-[[2-(trifluoromethyl)quinazolin-4-yl]amino]benzonitrile CAS Name: 4-[[2-(trifluoromethyl)-4-quinazolinyl]amino]benzonitrile IUPAC Name: 4-[[2-(trifluoromethyl)quinazolin-4-yl]amino]benzonitrile Traditional Name: 4-[[2-(trifluoromethyl)quinazolin-4-yl]amino]benzonitrile Formula: C16H9F3N4 MolecularWeight: 314.26467

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC(=N2)C(F)(F)F)NC3=CC=C(C=C3)C#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC(=N2)C(F)(F)F)NC3=CC=C(C=C3)C#N

InChI

InChI=1S/C16H9F3N4/c17-16(18,19)15-22-13-4-2-1-3-12(13)14(23-15)21-11-7-5-10(9-20)6-8-11/h1-8H,(H,21,22,23)