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

Systemtic Name: 8-bromanyl-N-(3-fluorophenyl)pyrimido[4,5-b][1,4]benzoxazepin-4-amine Openeye Name: 8-bromo-N-(3-fluorophenyl)pyrimido[4,5-b][1,4]benzoxazepin-4-amine CAS Name: 8-bromo-N-(3-fluorophenyl)-4-pyrimido[4,5-b][1,4]benzoxazepinamine IUPAC Name: 8-bromo-N-(3-fluorophenyl)pyrimido[4,5-b][1,4]benzoxazepin-4-amine Traditional Name: (8-bromopyrimido[4,5-b][1,4]benzoxazepin-4-yl)-(3-fluorophenyl)amine Formula: C17H10BrFN4O MolecularWeight: 385.189903

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)F)NC2=C3C(=NC=N2)OC4=C(C=C(C=C4)Br)C=N3

Isomeric SMILES

C1=CC(=CC(=C1)F)NC2=C3C(=NC=N2)OC4=C(C=C(C=C4)Br)C=N3

InChI

InChI=1S/C17H10BrFN4O/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/h1-9H,(H,21,22,23)