(1,3-diphenylpyrazol-4-yl)methyl 2-(4-oxidanylidenequinazolin-3-yl)ethanoate

Systemtic Name: (1,3-diphenylpyrazol-4-yl)methyl 2-(4-oxidanylidenequinazolin-3-yl)ethanoate Openeye Name: (1,3-diphenylpyrazol-4-yl)methyl 2-(4-oxoquinazolin-3-yl)acetate CAS Name: 2-(4-oxo-3-quinazolinyl)acetic acid (1,3-diphenyl-4-pyrazolyl)methyl ester IUPAC Name: (1,3-diphenylpyrazol-4-yl)methyl 2-(4-oxoquinazolin-3-yl)acetate Traditional Name: 2-(4-ketoquinazolin-3-yl)acetic acid (1,3-diphenylpyrazol-4-yl)methyl ester Formula: C26H20N4O3 MolecularWeight: 436.462

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C=C2COC(=O)CN3C=NC4=CC=CC=C4C3=O)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C=C2COC(=O)CN3C=NC4=CC=CC=C4C3=O)C5=CC=CC=C5

InChI

InChI=1S/C26H20N4O3/c31-24(16-29-18-27-23-14-8-7-13-22(23)26(29)32)33-17-20-15-30(21-11-5-2-6-12-21)28-25(20)19-9-3-1-4-10-19/h1-15,18H,16-17H2