N-(1-phenylethyl)quinazoline-2-carboxamide; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name: N-(1-phenylethyl)quinazoline-2-carboxamide; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: N-(1-phenylethyl)quinazoline-2-carboxamide; 2,2,2-trifluoroacetic acid CAS Name: N-(1-phenylethyl)-2-quinazolinecarboxamide; 2,2,2-trifluoroacetic acid IUPAC Name: N-(1-phenylethyl)quinazoline-2-carboxamide; 2,2,2-trifluoroacetic acid Traditional Name: N-(1-phenylethyl)quinazoline-2-carboxamide; 2,2,2-trifluoroacetic acid Formula: C21H17F6N3O5 MolecularWeight: 505.367199

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C2=NC3=CC=CC=C3C=N2.C(=O)(C(F)(F)F)O.C(=O)(C(F)(F)F)O

Isomeric SMILES

CC(C1=CC=CC=C1)NC(=O)C2=NC3=CC=CC=C3C=N2.C(=O)(C(F)(F)F)O.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C17H15N3O.2C2HF3O2/c1-12(13-7-3-2-4-8-13)19-17(21)16-18-11-14-9-5-6-10-15(14)20-16;2*3-2(4,5)1(6)7/h2-12H,1H3,(H,19,21);2*(H,6,7)