2-[4-[[4-oxidanylidene-6-(3-phenylprop-1-ynyl)quinazolin-3-yl]methyl]phenyl]ethanamide

Systemtic Name: 2-[4-[[4-oxidanylidene-6-(3-phenylprop-1-ynyl)quinazolin-3-yl]methyl]phenyl]ethanamide Openeye Name: 2-[4-[[4-oxo-6-(3-phenylprop-1-ynyl)quinazolin-3-yl]methyl]phenyl]acetamide CAS Name: 2-[4-[[4-oxo-6-(3-phenylprop-1-ynyl)-3-quinazolinyl]methyl]phenyl]acetamide IUPAC Name: 2-[4-[[4-oxo-6-(3-phenylprop-1-ynyl)quinazolin-3-yl]methyl]phenyl]acetamide Traditional Name: 2-[4-[[4-keto-6-(3-phenylprop-1-ynyl)quinazolin-3-yl]methyl]phenyl]acetamide Formula: C26H21N3O2 MolecularWeight: 407.46384

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC#CC2=CC3=C(C=C2)N=CN(C3=O)CC4=CC=C(C=C4)CC(=O)N

Isomeric SMILES

C1=CC=C(C=C1)CC#CC2=CC3=C(C=C2)N=CN(C3=O)CC4=CC=C(C=C4)CC(=O)N

InChI

InChI=1S/C26H21N3O2/c27-25(30)16-21-9-11-22(12-10-21)17-29-18-28-24-14-13-20(15-23(24)26(29)31)8-4-7-19-5-2-1-3-6-19/h1-3,5-6,9-15,18H,7,16-17H2,(H2,27,30)