8-bromanyl-N-phenyl-5,6-dihydropyrimido[4,5-b][1,4]benzoxazepin-4-amine

Systemtic Name: 8-bromanyl-N-phenyl-5,6-dihydropyrimido[4,5-b][1,4]benzoxazepin-4-amine Openeye Name: 8-bromo-N-phenyl-5,6-dihydropyrimido[4,5-b][1,4]benzoxazepin-4-amine CAS Name: 8-bromo-N-phenyl-5,6-dihydropyrimido[4,5-b][1,4]benzoxazepin-4-amine IUPAC Name: 8-bromo-N-phenyl-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)-phenyl-amine Formula: C17H13BrN4O MolecularWeight: 369.21532

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H13BrN4O/c18-12-6-7-14-11(8-12)9-19-15-16(20-10-21-17(15)23-14)22-13-4-2-1-3-5-13/h1-8,10,19H,9H2,(H,20,21,22)