3,5-bis(oxidanyl)-6-[4-(1-phenylethylamino)quinazolin-6-yl]oxy-N-(1H-pyrazol-4-yl)hexanamide

Systemtic Name: 3,5-bis(oxidanyl)-6-[4-(1-phenylethylamino)quinazolin-6-yl]oxy-N-(1H-pyrazol-4-yl)hexanamide Openeye Name: 3,5-dihydroxy-6-[4-(1-phenylethylamino)quinazolin-6-yl]oxy-N-(1H-pyrazol-4-yl)hexanamide CAS Name: 3,5-dihydroxy-6-[[4-(1-phenylethylamino)-6-quinazolinyl]oxy]-N-(1H-pyrazol-4-yl)hexanamide IUPAC Name: 3,5-dihydroxy-6-[4-(1-phenylethylamino)quinazolin-6-yl]oxy-N-(1H-pyrazol-4-yl)hexanamide Traditional Name: 3,5-dihydroxy-6-[4-(1-phenylethylamino)quinazolin-6-yl]oxy-N-(1H-pyrazol-4-yl)hexanamide Formula: C25H28N6O4 MolecularWeight: 476.52762

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC2=NC=NC3=C2C=C(C=C3)OCC(CC(CC(=O)NC4=CNN=C4)O)O

Isomeric SMILES

CC(C1=CC=CC=C1)NC2=NC=NC3=C2C=C(C=C3)OCC(CC(CC(=O)NC4=CNN=C4)O)O

InChI

InChI=1S/C25H28N6O4/c1-16(17-5-3-2-4-6-17)30-25-22-11-21(7-8-23(22)26-15-27-25)35-14-20(33)9-19(32)10-24(34)31-18-12-28-29-13-18/h2-8,11-13,15-16,19-20,32-33H,9-10,14H2,1H3,(H,28,29)(H,31,34)(H,26,27,30)