2-azanyl-3-phenyl-N-(7-phenyl-5H-pyrimido[5,4-d][2]benzazepin-5-yl)propanamide

Systemtic Name: 2-azanyl-3-phenyl-N-(7-phenyl-5H-pyrimido[5,4-d][2]benzazepin-5-yl)propanamide Openeye Name: 2-amino-3-phenyl-N-(7-phenyl-5H-pyrimido[5,4-d][2]benzazepin-5-yl)propanamide CAS Name: 2-amino-3-phenyl-N-(7-phenyl-5H-pyrimido[5,4-d][2]benzazepin-5-yl)propanamide IUPAC Name: 2-amino-3-phenyl-N-(7-phenyl-5H-pyrimido[5,4-d][2]benzazepin-5-yl)propanamide Traditional Name: 2-amino-3-phenyl-N-(7-phenyl-5H-pyrimido[5,4-d][2]benzazepin-5-yl)propionamide Formula: C27H23N5O MolecularWeight: 433.50442

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)NC2C3=CN=CN=C3C4=CC=CC=C4C(=N2)C5=CC=CC=C5)N

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)NC2C3=CN=CN=C3C4=CC=CC=C4C(=N2)C5=CC=CC=C5)N

InChI

InChI=1S/C27H23N5O/c28-23(15-18-9-3-1-4-10-18)27(33)32-26-22-16-29-17-30-25(22)21-14-8-7-13-20(21)24(31-26)19-11-5-2-6-12-19/h1-14,16-17,23,26H,15,28H2,(H,32,33)