2-azanyl-3-[4-azanyl-6-[2,4,6-tris(bromanyl)phenoxy]-1,3,5-triazin-2-yl]benzenecarbonitrile

Systemtic Name: 2-azanyl-3-[4-azanyl-6-[2,4,6-tris(bromanyl)phenoxy]-1,3,5-triazin-2-yl]benzenecarbonitrile Openeye Name: 2-amino-3-[4-amino-6-(2,4,6-tribromophenoxy)-1,3,5-triazin-2-yl]benzonitrile CAS Name: 2-amino-3-[4-amino-6-(2,4,6-tribromophenoxy)-1,3,5-triazin-2-yl]benzonitrile IUPAC Name: 2-amino-3-[4-amino-6-(2,4,6-tribromophenoxy)-1,3,5-triazin-2-yl]benzonitrile Traditional Name: 2-amino-3-[4-amino-6-(2,4,6-tribromophenoxy)-s-triazin-2-yl]benzonitrile Formula: C16H9Br3N6O MolecularWeight: 540.99426

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)C2=NC(=NC(=N2)OC3=C(C=C(C=C3Br)Br)Br)N)N)C#N

Isomeric SMILES

C1=CC(=C(C(=C1)C2=NC(=NC(=N2)OC3=C(C=C(C=C3Br)Br)Br)N)N)C#N

InChI

InChI=1S/C16H9Br3N6O/c17-8-4-10(18)13(11(19)5-8)26-16-24-14(23-15(22)25-16)9-3-1-2-7(6-20)12(9)21/h1-5H,21H2,(H2,22,23,24,25)