7-imidazol-1-yl-N-[4-(1-phenylethylamino)quinazolin-6-yl]hept-2-ynamide

Systemtic Name: 7-imidazol-1-yl-N-[4-(1-phenylethylamino)quinazolin-6-yl]hept-2-ynamide Openeye Name: 7-imidazol-1-yl-N-[4-(1-phenylethylamino)quinazolin-6-yl]hept-2-ynamide CAS Name: 7-(1-imidazolyl)-N-[4-(1-phenylethylamino)-6-quinazolinyl]-2-heptynamide IUPAC Name: 7-imidazol-1-yl-N-[4-(1-phenylethylamino)quinazolin-6-yl]hept-2-ynamide Traditional Name: 7-imidazol-1-yl-N-[4-(1-phenylethylamino)quinazolin-6-yl]hept-2-ynamide Formula: C26H26N6O MolecularWeight: 438.52424

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC2=NC=NC3=C2C=C(C=C3)NC(=O)C#CCCCCN4C=CN=C4

Isomeric SMILES

CC(C1=CC=CC=C1)NC2=NC=NC3=C2C=C(C=C3)NC(=O)C#CCCCCN4C=CN=C4

InChI

InChI=1S/C26H26N6O/c1-20(21-9-5-4-6-10-21)30-26-23-17-22(12-13-24(23)28-18-29-26)31-25(33)11-7-2-3-8-15-32-16-14-27-19-32/h4-6,9-10,12-14,16-20H,2-3,8,15H2,1H3,(H,31,33)(H,28,29,30)