8-bromanyl-N-(3-fluorophenyl)-5,6-dihydropyrimido[4,5-b][1,4]benzoxazepin-4-amine

Systemtic Name: 8-bromanyl-N-(3-fluorophenyl)-5,6-dihydropyrimido[4,5-b][1,4]benzoxazepin-4-amine Openeye Name: 8-bromo-N-(3-fluorophenyl)-5,6-dihydropyrimido[4,5-b][1,4]benzoxazepin-4-amine CAS Name: 8-bromo-N-(3-fluorophenyl)-5,6-dihydropyrimido[4,5-b][1,4]benzoxazepin-4-amine IUPAC Name: 8-bromo-N-(3-fluorophenyl)-5,6-dihydropyrimido[4,5-b][1,4]benzoxazepin-4-amine Traditional Name: (8-bromo-5,6-dihydropyrimido[4,5-b][1,4]benzoxazepin-4-yl)-(3-fluorophenyl)amine Formula: C17H12BrFN4O MolecularWeight: 387.205783

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=CC(=C2)Br)OC3=NC=NC(=C3N1)NC4=CC(=CC=C4)F

Isomeric SMILES

C1C2=C(C=CC(=C2)Br)OC3=NC=NC(=C3N1)NC4=CC(=CC=C4)F

InChI

InChI=1S/C17H12BrFN4O/c18-11-4-5-14-10(6-11)8-20-15-16(21-9-22-17(15)24-14)23-13-3-1-2-12(19)7-13/h1-7,9,20H,8H2,(H,21,22,23)