(E)-N-[7-cyclopentyloxy-4-(1-phenylethylamino)quinazolin-6-yl]-4-morpholin-4-yl-but-2-enamide

Systemtic Name: (E)-N-[7-cyclopentyloxy-4-(1-phenylethylamino)quinazolin-6-yl]-4-morpholin-4-yl-but-2-enamide Openeye Name: (E)-N-[7-(cyclopentoxy)-4-(1-phenylethylamino)quinazolin-6-yl]-4-morpholino-but-2-enamide CAS Name: (E)-N-[7-cyclopentyloxy-4-(1-phenylethylamino)-6-quinazolinyl]-4-(4-morpholinyl)-2-butenamide IUPAC Name: (E)-N-[7-cyclopentyloxy-4-(1-phenylethylamino)quinazolin-6-yl]-4-morpholin-4-ylbut-2-enamide Traditional Name: (E)-N-[7-(cyclopentoxy)-4-(1-phenylethylamino)quinazolin-6-yl]-4-morpholino-but-2-enamide Formula: C29H35N5O3 MolecularWeight: 501.6199

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC2=NC=NC3=CC(=C(C=C32)NC(=O)C=CCN4CCOCC4)OC5CCCC5

Isomeric SMILES

CC(C1=CC=CC=C1)NC2=NC=NC3=CC(=C(C=C32)NC(=O)/C=C/CN4CCOCC4)OC5CCCC5

InChI

InChI=1S/C29H35N5O3/c1-21(22-8-3-2-4-9-22)32-29-24-18-26(33-28(35)12-7-13-34-14-16-36-17-15-34)27(19-25(24)30-20-31-29)37-23-10-5-6-11-23/h2-4,7-9,12,18-21,23H,5-6,10-11,13-17H2,1H3,(H,33,35)(H,30,31,32)/b12-7+