N-[(1,3-diphenylpyrazol-4-yl)methyl]-2-(6-fluoranyl-4-oxidanylidene-quinazolin-3-yl)ethanamide

Systemtic Name: N-[(1,3-diphenylpyrazol-4-yl)methyl]-2-(6-fluoranyl-4-oxidanylidene-quinazolin-3-yl)ethanamide Openeye Name: N-[(1,3-diphenylpyrazol-4-yl)methyl]-2-(6-fluoro-4-oxo-quinazolin-3-yl)acetamide CAS Name: N-[(1,3-diphenyl-4-pyrazolyl)methyl]-2-(6-fluoro-4-oxo-3-quinazolinyl)acetamide IUPAC Name: N-[(1,3-diphenylpyrazol-4-yl)methyl]-2-(6-fluoro-4-oxoquinazolin-3-yl)acetamide Traditional Name: N-[(1,3-diphenylpyrazol-4-yl)methyl]-2-(6-fluoro-4-keto-quinazolin-3-yl)acetamide Formula: C26H20FN5O2 MolecularWeight: 453.467703

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C=C2CNC(=O)CN3C=NC4=C(C3=O)C=C(C=C4)F)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C=C2CNC(=O)CN3C=NC4=C(C3=O)C=C(C=C4)F)C5=CC=CC=C5

InChI

InChI=1S/C26H20FN5O2/c27-20-11-12-23-22(13-20)26(34)31(17-29-23)16-24(33)28-14-19-15-32(21-9-5-2-6-10-21)30-25(19)18-7-3-1-4-8-18/h1-13,15,17H,14,16H2,(H,28,33)