4,5-diphenyl-2-[2-(3-propylphenyl)phenyl]-1,2,4-triazol-3-one

Systemtic Name: 4,5-diphenyl-2-[2-(3-propylphenyl)phenyl]-1,2,4-triazol-3-one Openeye Name: 4,5-diphenyl-2-[2-(3-propylphenyl)phenyl]-1,2,4-triazol-3-one CAS Name: 4,5-diphenyl-2-[2-(3-propylphenyl)phenyl]-1,2,4-triazol-3-one IUPAC Name: 4,5-diphenyl-2-[2-(3-propylphenyl)phenyl]-1,2,4-triazol-3-one Traditional Name: 4,5-diphenyl-2-[2-(3-propylphenyl)phenyl]-1,2,4-triazol-3-one Formula: C29H25N3O MolecularWeight: 431.5283

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=CC(=C1)C2=CC=CC=C2N3C(=O)N(C(=N3)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCCC1=CC=CC(=C1)C2=CC=CC=C2N3C(=O)N(C(=N3)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H25N3O/c1-2-12-22-13-11-16-24(21-22)26-19-9-10-20-27(26)32-29(33)31(25-17-7-4-8-18-25)28(30-32)23-14-5-3-6-15-23/h3-11,13-21H,2,12H2,1H3