3-(2-chlorophenyl)-1-methyl-5-(4-tridecylphenyl)-1,2,4-triazole

Systemtic Name: 3-(2-chlorophenyl)-1-methyl-5-(4-tridecylphenyl)-1,2,4-triazole Openeye Name: 3-(2-chlorophenyl)-1-methyl-5-(4-tridecylphenyl)-1,2,4-triazole CAS Name: 3-(2-chlorophenyl)-1-methyl-5-(4-tridecylphenyl)-1,2,4-triazole IUPAC Name: 3-(2-chlorophenyl)-1-methyl-5-(4-tridecylphenyl)-1,2,4-triazole Traditional Name: 3-(2-chlorophenyl)-1-methyl-5-(4-tridecylphenyl)-1,2,4-triazole Formula: C28H38ClN3 MolecularWeight: 452.07442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC1=CC=C(C=C1)C2=NC(=NN2C)C3=CC=CC=C3Cl

Isomeric SMILES

CCCCCCCCCCCCCC1=CC=C(C=C1)C2=NC(=NN2C)C3=CC=CC=C3Cl

InChI

InChI=1S/C28H38ClN3/c1-3-4-5-6-7-8-9-10-11-12-13-16-23-19-21-24(22-20-23)28-30-27(31-32(28)2)25-17-14-15-18-26(25)29/h14-15,17-22H,3-13,16H2,1-2H3