9-bromanyl-3,4-diphenyl-1H-[1,2,4,5]tetrazepino[3,2-b]quinazolin-7-one

Systemtic Name: 9-bromanyl-3,4-diphenyl-1H-[1,2,4,5]tetrazepino[3,2-b]quinazolin-7-one Openeye Name: 9-bromo-3,4-diphenyl-1H-[1,2,4,5]tetrazepino[3,2-b]quinazolin-7-one CAS Name: 9-bromo-3,4-diphenyl-1H-[1,2,4,5]tetrazepino[3,2-b]quinazolin-7-one IUPAC Name: 9-bromo-3,4-diphenyl-1H-[1,2,4,5]tetrazepino[3,2-b]quinazolin-7-one Traditional Name: 9-bromo-3,4-diphenyl-1H-[1,2,4,5]tetrazepino[3,2-b]quinazolin-7-one Formula: C22H14BrN5O MolecularWeight: 444.28346

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NNC3=NC4=C(C=C(C=C4)Br)C(=O)N3N=C2C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=NNC3=NC4=C(C=C(C=C4)Br)C(=O)N3N=C2C5=CC=CC=C5

InChI

InChI=1S/C22H14BrN5O/c23-16-11-12-18-17(13-16)21(29)28-22(24-18)26-25-19(14-7-3-1-4-8-14)20(27-28)15-9-5-2-6-10-15/h1-13H,(H,24,26)