(1,3-diphenylpyrazol-4-yl)methyl 2-(8-methyl-4-oxidanylidene-quinazolin-3-yl)ethanoate

Systemtic Name: (1,3-diphenylpyrazol-4-yl)methyl 2-(8-methyl-4-oxidanylidene-quinazolin-3-yl)ethanoate Openeye Name: (1,3-diphenylpyrazol-4-yl)methyl 2-(8-methyl-4-oxo-quinazolin-3-yl)acetate CAS Name: 2-(8-methyl-4-oxo-3-quinazolinyl)acetic acid (1,3-diphenyl-4-pyrazolyl)methyl ester IUPAC Name: (1,3-diphenylpyrazol-4-yl)methyl 2-(8-methyl-4-oxoquinazolin-3-yl)acetate Traditional Name: 2-(4-keto-8-methyl-quinazolin-3-yl)acetic acid (1,3-diphenylpyrazol-4-yl)methyl ester Formula: C27H22N4O3 MolecularWeight: 450.48858

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=CN(C2=O)CC(=O)OCC3=CN(N=C3C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=CC2=C1N=CN(C2=O)CC(=O)OCC3=CN(N=C3C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H22N4O3/c1-19-9-8-14-23-25(19)28-18-30(27(23)33)16-24(32)34-17-21-15-31(22-12-6-3-7-13-22)29-26(21)20-10-4-2-5-11-20/h2-15,18H,16-17H2,1H3