(2S)-2-[[6-methyl-2-(trifluoromethyl)quinazolin-4-yl]amino]-2-phenyl-ethanoate

Systemtic Name: (2S)-2-[[6-methyl-2-(trifluoromethyl)quinazolin-4-yl]amino]-2-phenyl-ethanoate Openeye Name: (2S)-2-[[6-methyl-2-(trifluoromethyl)quinazolin-4-yl]amino]-2-phenyl-acetate CAS Name: (2S)-2-[[6-methyl-2-(trifluoromethyl)-4-quinazolinyl]amino]-2-phenylacetate IUPAC Name: (2S)-2-[[6-methyl-2-(trifluoromethyl)quinazolin-4-yl]amino]-2-phenylacetate Traditional Name: (2S)-2-[[6-methyl-2-(trifluoromethyl)quinazolin-4-yl]amino]-2-phenyl-acetate Formula: C18H13F3N3O2- MolecularWeight: 360.30993

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N=C2NC(C3=CC=CC=C3)C(=O)[O-])C(F)(F)F

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N=C2N[C@@H](C3=CC=CC=C3)C(=O)[O-])C(F)(F)F

InChI

InChI=1S/C18H14F3N3O2/c1-10-7-8-13-12(9-10)15(24-17(22-13)18(19,20)21)23-14(16(25)26)11-5-3-2-4-6-11/h2-9,14H,1H3,(H,25,26)(H,22,23,24)/p-1/t14-/m0/s1