5-[[2-[2-(trifluoromethyl)phenyl]quinazolin-4-yl]amino]-1H-pyrazole-4-carboxamide

Systemtic Name: 5-[[2-[2-(trifluoromethyl)phenyl]quinazolin-4-yl]amino]-1H-pyrazole-4-carboxamide Openeye Name: 5-[[2-[2-(trifluoromethyl)phenyl]quinazolin-4-yl]amino]-1H-pyrazole-4-carboxamide CAS Name: 5-[[2-[2-(trifluoromethyl)phenyl]-4-quinazolinyl]amino]-1H-pyrazole-4-carboxamide IUPAC Name: 5-[[2-[2-(trifluoromethyl)phenyl]quinazolin-4-yl]amino]-1H-pyrazole-4-carboxamide Traditional Name: 5-[[2-[2-(trifluoromethyl)phenyl]quinazolin-4-yl]amino]-1H-pyrazole-4-carboxamide Formula: C19H13F3N6O MolecularWeight: 398.34133

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=NC3=CC=CC=C3C(=N2)NC4=C(C=NN4)C(=O)N)C(F)(F)F

Isomeric SMILES

C1=CC=C(C(=C1)C2=NC3=CC=CC=C3C(=N2)NC4=C(C=NN4)C(=O)N)C(F)(F)F

InChI

InChI=1S/C19H13F3N6O/c20-19(21,22)13-7-3-1-5-10(13)16-25-14-8-4-2-6-11(14)17(26-16)27-18-12(15(23)29)9-24-28-18/h1-9H,(H2,23,29)(H2,24,25,26,27,28)