3-[2-(4-methylphenoxy)ethylsulfanyl]-4-(3-methylphenyl)-5-(phenylmethyl)-1,2,4-triazole

Systemtic Name: 3-[2-(4-methylphenoxy)ethylsulfanyl]-4-(3-methylphenyl)-5-(phenylmethyl)-1,2,4-triazole Openeye Name: 3-benzyl-5-[2-(4-methylphenoxy)ethylsulfanyl]-4-(m-tolyl)-1,2,4-triazole CAS Name: 3-[2-(4-methylphenoxy)ethylthio]-4-(3-methylphenyl)-5-(phenylmethyl)-1,2,4-triazole IUPAC Name: 3-benzyl-5-[2-(4-methylphenoxy)ethylsulfanyl]-4-(3-methylphenyl)-1,2,4-triazole Traditional Name: 3-benzyl-5-[2-(4-methylphenoxy)ethylthio]-4-(m-tolyl)-1,2,4-triazole Formula: C25H25N3OS MolecularWeight: 415.5505

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCCSC2=NN=C(N2C3=CC=CC(=C3)C)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)OCCSC2=NN=C(N2C3=CC=CC(=C3)C)CC4=CC=CC=C4

InChI

InChI=1S/C25H25N3OS/c1-19-11-13-23(14-12-19)29-15-16-30-25-27-26-24(18-21-8-4-3-5-9-21)28(25)22-10-6-7-20(2)17-22/h3-14,17H,15-16,18H2,1-2H3