2-[[4-[[2-(trifluoromethyl)quinazolin-4-yl]amino]phenyl]carbonylamino]ethanoate

Systemtic Name: 2-[[4-[[2-(trifluoromethyl)quinazolin-4-yl]amino]phenyl]carbonylamino]ethanoate Openeye Name: 2-[[4-[[2-(trifluoromethyl)quinazolin-4-yl]amino]benzoyl]amino]acetate CAS Name: 2-[[oxo-[4-[[2-(trifluoromethyl)-4-quinazolinyl]amino]phenyl]methyl]amino]acetate IUPAC Name: 2-[[4-[[2-(trifluoromethyl)quinazolin-4-yl]amino]benzoyl]amino]acetate Traditional Name: 2-[[4-[[2-(trifluoromethyl)quinazolin-4-yl]amino]benzoyl]amino]acetate Formula: C18H12F3N4O3- MolecularWeight: 389.30809

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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(=O)NCC(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC(=N2)C(F)(F)F)NC3=CC=C(C=C3)C(=O)NCC(=O)[O-]

InChI

InChI=1S/C18H13F3N4O3/c19-18(20,21)17-24-13-4-2-1-3-12(13)15(25-17)23-11-7-5-10(6-8-11)16(28)22-9-14(26)27/h1-8H,9H2,(H,22,28)(H,26,27)(H,23,24,25)/p-1