N-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-2-(8-methyl-4-oxidanylidene-quinazolin-3-yl)ethanamide

Systemtic Name: N-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-2-(8-methyl-4-oxidanylidene-quinazolin-3-yl)ethanamide Openeye Name: N-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-2-(8-methyl-4-oxo-quinazolin-3-yl)acetamide CAS Name: N-[[3-(4-fluorophenyl)-1-phenyl-4-pyrazolyl]methyl]-2-(8-methyl-4-oxo-3-quinazolinyl)acetamide IUPAC Name: N-[[3-(4-fluorophenyl)-1-phenylpyrazol-4-yl]methyl]-2-(8-methyl-4-oxoquinazolin-3-yl)acetamide Traditional Name: N-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-2-(4-keto-8-methyl-quinazolin-3-yl)acetamide Formula: C27H22FN5O2 MolecularWeight: 467.494283

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=CN(C2=O)CC(=O)NCC3=CN(N=C3C4=CC=C(C=C4)F)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=CC2=C1N=CN(C2=O)CC(=O)NCC3=CN(N=C3C4=CC=C(C=C4)F)C5=CC=CC=C5

InChI

InChI=1S/C27H22FN5O2/c1-18-6-5-9-23-25(18)30-17-32(27(23)35)16-24(34)29-14-20-15-33(22-7-3-2-4-8-22)31-26(20)19-10-12-21(28)13-11-19/h2-13,15,17H,14,16H2,1H3,(H,29,34)