5-(4-ethylphenyl)-2-phenyl-1H-1,2,4-triazol-3-one

Systemtic Name: 5-(4-ethylphenyl)-2-phenyl-1H-1,2,4-triazol-3-one Openeye Name: 5-(4-ethylphenyl)-2-phenyl-1H-1,2,4-triazol-3-one CAS Name: 5-(4-ethylphenyl)-2-phenyl-1H-1,2,4-triazol-3-one IUPAC Name: 5-(4-ethylphenyl)-2-phenyl-1H-1,2,4-triazol-3-one Traditional Name: 5-(4-ethylphenyl)-2-phenyl-1H-1,2,4-triazol-3-one Formula: C16H15N3O MolecularWeight: 265.3098

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NC(=O)N(N2)C3=CC=CC=C3

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NC(=O)N(N2)C3=CC=CC=C3

InChI

InChI=1S/C16H15N3O/c1-2-12-8-10-13(11-9-12)15-17-16(20)19(18-15)14-6-4-3-5-7-14/h3-11H,2H2,1H3,(H,17,18,20)