3-[1-(6-methoxynaphthalen-2-yl)ethyl]-4-(2-methylphenyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-[1-(6-methoxynaphthalen-2-yl)ethyl]-4-(2-methylphenyl)-1H-1,2,4-triazole-5-thione Openeye Name: 3-[1-(6-methoxy-2-naphthyl)ethyl]-4-(o-tolyl)-1H-1,2,4-triazole-5-thione CAS Name: 3-[1-(6-methoxy-2-naphthalenyl)ethyl]-4-(2-methylphenyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[1-(6-methoxynaphthalen-2-yl)ethyl]-4-(2-methylphenyl)-1H-1,2,4-triazole-5-thione Traditional Name: 3-[1-(6-methoxy-2-naphthyl)ethyl]-4-(o-tolyl)-1H-1,2,4-triazole-5-thione Formula: C22H21N3OS MolecularWeight: 375.48664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=NNC2=S)C(C)C3=CC4=C(C=C3)C=C(C=C4)OC

Isomeric SMILES

CC1=CC=CC=C1N2C(=NNC2=S)C(C)C3=CC4=C(C=C3)C=C(C=C4)OC

InChI

InChI=1S/C22H21N3OS/c1-14-6-4-5-7-20(14)25-21(23-24-22(25)27)15(2)16-8-9-18-13-19(26-3)11-10-17(18)12-16/h4-13,15H,1-3H3,(H,24,27)