N-(6-phenyl-4H-pyrrolo[1,2-a][1,4]benzodiazepin-4-yl)-1H-indole-2-carboxamide

Systemtic Name: N-(6-phenyl-4H-pyrrolo[1,2-a][1,4]benzodiazepin-4-yl)-1H-indole-2-carboxamide Openeye Name: N-(6-phenyl-4H-pyrrolo[1,2-a][1,4]benzodiazepin-4-yl)-1H-indole-2-carboxamide CAS Name: N-(6-phenyl-4H-pyrrolo[1,2-a][1,4]benzodiazepin-4-yl)-1H-indole-2-carboxamide IUPAC Name: N-(6-phenyl-4H-pyrrolo[1,2-a][1,4]benzodiazepin-4-yl)-1H-indole-2-carboxamide Traditional Name: N-(6-phenyl-4H-pyrrolo[1,2-a][1,4]benzodiazepin-4-yl)-1H-indole-2-carboxamide Formula: C27H20N4O MolecularWeight: 416.4739

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(C3=CC=CN3C4=CC=CC=C42)NC(=O)C5=CC6=CC=CC=C6N5

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(C3=CC=CN3C4=CC=CC=C42)NC(=O)C5=CC6=CC=CC=C6N5

InChI

InChI=1S/C27H20N4O/c32-27(22-17-19-11-4-6-13-21(19)28-22)30-26-24-15-8-16-31(24)23-14-7-5-12-20(23)25(29-26)18-9-2-1-3-10-18/h1-17,26,28H,(H,30,32)