3-(5-bromanylfuran-2-yl)-N-(11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)prop-2-enamide

Systemtic Name: 3-(5-bromanylfuran-2-yl)-N-(11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)prop-2-enamide Openeye Name: 3-(5-bromo-2-furyl)-N-(11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)prop-2-enamide CAS Name: 3-(5-bromo-2-furanyl)-N-(11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-2-propenamide IUPAC Name: 3-(5-bromofuran-2-yl)-N-(11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)prop-2-enamide Traditional Name: 3-(5-bromo-2-furyl)-N-(11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)acrylamide Formula: C20H14BrN3O2 MolecularWeight: 408.24806

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(=NC(=O)C=CC3=CC=C(O3)Br)N=C4N1C=CC=C4

Isomeric SMILES

C1C2=CC=CC=C2C(=NC(=O)C=CC3=CC=C(O3)Br)N=C4N1C=CC=C4

InChI

InChI=1S/C20H14BrN3O2/c21-17-10-8-15(26-17)9-11-19(25)23-20-16-6-2-1-5-14(16)13-24-12-4-3-7-18(24)22-20/h1-12H,13H2