2-(3-bromanylphenoxy)-N-(11H-pyrimido[1,2-b][2,4]benzodiazepin-6-ylidene)ethanamide

Systemtic Name: 2-(3-bromanylphenoxy)-N-(11H-pyrimido[1,2-b][2,4]benzodiazepin-6-ylidene)ethanamide Openeye Name: 2-(3-bromophenoxy)-N-(11H-pyrimido[1,2-b][2,4]benzodiazepin-6-ylidene)acetamide CAS Name: 2-(3-bromophenoxy)-N-(11H-pyrimido[1,2-b][2,4]benzodiazepin-6-ylidene)acetamide IUPAC Name: 2-(3-bromophenoxy)-N-(11H-pyrimido[1,2-b][2,4]benzodiazepin-6-ylidene)acetamide Traditional Name: 2-(3-bromophenoxy)-N-(11H-pyrimido[1,2-b][2,4]benzodiazepin-6-ylidene)acetamide Formula: C20H15BrN4O2 MolecularWeight: 423.2627

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(=NC(=O)COC3=CC(=CC=C3)Br)N=C4N1C=CC=N4

Isomeric SMILES

C1C2=CC=CC=C2C(=NC(=O)COC3=CC(=CC=C3)Br)N=C4N1C=CC=N4

InChI

InChI=1S/C20H15BrN4O2/c21-15-6-3-7-16(11-15)27-13-18(26)23-19-17-8-2-1-5-14(17)12-25-10-4-9-22-20(25)24-19/h1-11H,12-13H2