4-(4-ethoxyphenyl)-3-(4-methylphenyl)-5-[(2-methylphenyl)methylsulfanyl]-1,2,4-triazole

Systemtic Name: 4-(4-ethoxyphenyl)-3-(4-methylphenyl)-5-[(2-methylphenyl)methylsulfanyl]-1,2,4-triazole Openeye Name: 4-(4-ethoxyphenyl)-3-(o-tolylmethylsulfanyl)-5-(p-tolyl)-1,2,4-triazole CAS Name: 4-(4-ethoxyphenyl)-3-(4-methylphenyl)-5-[(2-methylphenyl)methylthio]-1,2,4-triazole IUPAC Name: 4-(4-ethoxyphenyl)-3-(4-methylphenyl)-5-[(2-methylphenyl)methylsulfanyl]-1,2,4-triazole Traditional Name: 3-[(2-methylbenzyl)thio]-4-p-phenetyl-5-(p-tolyl)-1,2,4-triazole Formula: C25H25N3OS MolecularWeight: 415.5505

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=CC=C3C)C4=CC=C(C=C4)C

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=CC=C3C)C4=CC=C(C=C4)C

InChI

InChI=1S/C25H25N3OS/c1-4-29-23-15-13-22(14-16-23)28-24(20-11-9-18(2)10-12-20)26-27-25(28)30-17-21-8-6-5-7-19(21)3/h5-16H,4,17H2,1-3H3