N-(2-bromanyl-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-2-phenyl-quinoline-4-carboxamide

Systemtic Name: N-(2-bromanyl-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-2-phenyl-quinoline-4-carboxamide Openeye Name: N-(2-bromo-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-2-phenyl-quinoline-4-carboxamide CAS Name: N-(2-bromo-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-2-phenyl-4-quinolinecarboxamide IUPAC Name: N-(2-bromo-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-2-phenylquinoline-4-carboxamide Traditional Name: N-(2-bromo-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-2-phenyl-cinchoninamide Formula: C29H19BrN4O MolecularWeight: 519.39136

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(=NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=C5)N=C6N1C=C(C=C6)Br

Isomeric SMILES

C1C2=CC=CC=C2C(=NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=C5)N=C6N1C=C(C=C6)Br

InChI

InChI=1S/C29H19BrN4O/c30-21-14-15-27-32-28(22-11-5-4-10-20(22)17-34(27)18-21)33-29(35)24-16-26(19-8-2-1-3-9-19)31-25-13-7-6-12-23(24)25/h1-16,18H,17H2