4-tert-butyl-N-(2-iodanyl-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)benzamide

Systemtic Name: 4-tert-butyl-N-(2-iodanyl-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)benzamide Openeye Name: 4-tert-butyl-N-(2-iodo-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)benzamide CAS Name: 4-tert-butyl-N-(2-iodo-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)benzamide IUPAC Name: 4-tert-butyl-N-(2-iodo-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)benzamide Traditional Name: 4-tert-butyl-N-(2-iodo-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)benzamide Formula: C24H22IN3O MolecularWeight: 495.35545

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)N=C2C3=CC=CC=C3CN4C=C(C=CC4=N2)I

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)N=C2C3=CC=CC=C3CN4C=C(C=CC4=N2)I

InChI

InChI=1S/C24H22IN3O/c1-24(2,3)18-10-8-16(9-11-18)23(29)27-22-20-7-5-4-6-17(20)14-28-15-19(25)12-13-21(28)26-22/h4-13,15H,14H2,1-3H3