1,3,3a,4,6-pentakis-phenyl-[1,2,4]triazolo[1,5-c][1,2,3]triazol-5-one

Systemtic Name: 1,3,3a,4,6-pentakis-phenyl-[1,2,4]triazolo[1,5-c][1,2,3]triazol-5-one Openeye Name: 1,3,3a,4,6-pentakis-phenyl-[1,2,4]triazolo[1,5-c]triazol-5-one CAS Name: 1,3,3a,4,6-pentakis-phenyl-[1,2,4]triazolo[1,5-c]triazol-5-one IUPAC Name: 1,3,3a,4,6-pentakis-phenyl-[1,2,4]triazolo[1,5-c]triazol-5-one Traditional Name: 1,3,3a,4,6-pentakis-phenyl-[1,2,4]triazolo[1,5-c]triazol-5-one Formula: C33H25N5O MolecularWeight: 507.5845

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(N3C2(N(C(=O)N3C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6)C7=CC=CC=C7

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(N3C2(N(C(=O)N3C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6)C7=CC=CC=C7

InChI

InChI=1S/C33H25N5O/c39-32-35(28-20-10-3-11-21-28)33(27-18-8-2-9-19-27)31(26-16-6-1-7-17-26)34-37(30-24-14-5-15-25-30)38(33)36(32)29-22-12-4-13-23-29/h1-25H