N-[2-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl]-3-(2-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)propanamide

Systemtic Name: N-[2-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl]-3-(2-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)propanamide Openeye Name: N-[2-(4-oxo-1H-quinazolin-2-yl)ethyl]-3-(2-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)propanamide CAS Name: N-[2-(4-oxo-1H-quinazolin-2-yl)ethyl]-3-(2-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)propanamide IUPAC Name: N-[2-(4-oxo-1H-quinazolin-2-yl)ethyl]-3-(2-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)propanamide Traditional Name: N-[2-(4-keto-1H-quinazolin-2-yl)ethyl]-3-(2-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)propionamide Formula: C28H28N4O3 MolecularWeight: 468.54692

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2CN1CCC(=O)NCCC3=NC(=O)C4=CC=CC=C4N3)C5=CC=CC=C5

Isomeric SMILES

C1C(OC2=CC=CC=C2CN1CCC(=O)NCCC3=NC(=O)C4=CC=CC=C4N3)C5=CC=CC=C5

InChI

InChI=1S/C28H28N4O3/c33-27(29-16-14-26-30-23-12-6-5-11-22(23)28(34)31-26)15-17-32-18-21-10-4-7-13-24(21)35-25(19-32)20-8-2-1-3-9-20/h1-13,25H,14-19H2,(H,29,33)(H,30,31,34)