2-azanyl-3-phenyl-N-(6-phenyl-4H-pyrrolo[1,2-a][1,4]benzodiazepin-4-yl)propanamide

Systemtic Name: 2-azanyl-3-phenyl-N-(6-phenyl-4H-pyrrolo[1,2-a][1,4]benzodiazepin-4-yl)propanamide Openeye Name: 2-amino-3-phenyl-N-(6-phenyl-4H-pyrrolo[1,2-a][1,4]benzodiazepin-4-yl)propanamide CAS Name: 2-amino-3-phenyl-N-(6-phenyl-4H-pyrrolo[1,2-a][1,4]benzodiazepin-4-yl)propanamide IUPAC Name: 2-amino-3-phenyl-N-(6-phenyl-4H-pyrrolo[1,2-a][1,4]benzodiazepin-4-yl)propanamide Traditional Name: 2-amino-3-phenyl-N-(6-phenyl-4H-pyrrolo[1,2-a][1,4]benzodiazepin-4-yl)propionamide Formula: C27H24N4O MolecularWeight: 420.50566

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)NC2C3=CC=CN3C4=CC=CC=C4C(=N2)C5=CC=CC=C5)N

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)NC2C3=CC=CN3C4=CC=CC=C4C(=N2)C5=CC=CC=C5)N

InChI

InChI=1S/C27H24N4O/c28-22(18-19-10-3-1-4-11-19)27(32)30-26-24-16-9-17-31(24)23-15-8-7-14-21(23)25(29-26)20-12-5-2-6-13-20/h1-17,22,26H,18,28H2,(H,30,32)