2-[3-(3-bromophenyl)-6-phenyl-1,2,4-triazin-5-yl]propanedinitrile

Systemtic Name: 2-[3-(3-bromophenyl)-6-phenyl-1,2,4-triazin-5-yl]propanedinitrile Openeye Name: 2-[3-(3-bromophenyl)-6-phenyl-1,2,4-triazin-5-yl]propanedinitrile CAS Name: 2-[3-(3-bromophenyl)-6-phenyl-1,2,4-triazin-5-yl]propanedinitrile IUPAC Name: 2-[3-(3-bromophenyl)-6-phenyl-1,2,4-triazin-5-yl]propanedinitrile Traditional Name: 2-[3-(3-bromophenyl)-6-phenyl-1,2,4-triazin-5-yl]malononitrile Formula: C18H10BrN5 MolecularWeight: 376.2095

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(N=C(N=N2)C3=CC(=CC=C3)Br)C(C#N)C#N

Isomeric SMILES

C1=CC=C(C=C1)C2=C(N=C(N=N2)C3=CC(=CC=C3)Br)C(C#N)C#N

InChI

InChI=1S/C18H10BrN5/c19-15-8-4-7-13(9-15)18-22-16(14(10-20)11-21)17(23-24-18)12-5-2-1-3-6-12/h1-9,14H