N-(2-iodanyl-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-2,2-diphenyl-ethanamide

Systemtic Name: N-(2-iodanyl-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-2,2-diphenyl-ethanamide Openeye Name: N-(2-iodo-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-2,2-diphenyl-acetamide CAS Name: N-(2-iodo-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-2,2-diphenylacetamide IUPAC Name: N-(2-iodo-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-2,2-diphenylacetamide Traditional Name: N-(2-iodo-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-2,2-diphenyl-acetamide Formula: C27H20IN3O MolecularWeight: 529.37167

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(=NC(=O)C(C3=CC=CC=C3)C4=CC=CC=C4)N=C5N1C=C(C=C5)I

Isomeric SMILES

C1C2=CC=CC=C2C(=NC(=O)C(C3=CC=CC=C3)C4=CC=CC=C4)N=C5N1C=C(C=C5)I

InChI

InChI=1S/C27H20IN3O/c28-22-15-16-24-29-26(23-14-8-7-13-21(23)17-31(24)18-22)30-27(32)25(19-9-3-1-4-10-19)20-11-5-2-6-12-20/h1-16,18,25H,17H2