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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1Br)OC2=C(C(=C(C(=C2)N)C3=NC=NC=N3)N)C#N)Br)Br

Isomeric SMILES

C1=C(C=C(C(=C1Br)OC2=C(C(=C(C(=C2)N)C3=NC=NC=N3)N)C#N)Br)Br

InChI

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