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

Systemtic Name: 2-[6-(4-chlorophenyl)-3-phenyl-1,2,4-triazin-5-yl]propanedinitrile Openeye Name: 2-[6-(4-chlorophenyl)-3-phenyl-1,2,4-triazin-5-yl]propanedinitrile CAS Name: 2-[6-(4-chlorophenyl)-3-phenyl-1,2,4-triazin-5-yl]propanedinitrile IUPAC Name: 2-[6-(4-chlorophenyl)-3-phenyl-1,2,4-triazin-5-yl]propanedinitrile Traditional Name: 2-[6-(4-chlorophenyl)-3-phenyl-1,2,4-triazin-5-yl]malononitrile Formula: C18H10ClN5 MolecularWeight: 331.7585

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=C(N=N2)C3=CC=C(C=C3)Cl)C(C#N)C#N

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=C(N=N2)C3=CC=C(C=C3)Cl)C(C#N)C#N

InChI

InChI=1S/C18H10ClN5/c19-15-8-6-12(7-9-15)17-16(14(10-20)11-21)22-18(24-23-17)13-4-2-1-3-5-13/h1-9,14H