3-(5-chloranyl-2-methoxy-phenyl)-4-(4-methylphenyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-(5-chloranyl-2-methoxy-phenyl)-4-(4-methylphenyl)-1H-1,2,4-triazole-5-thione Openeye Name: 3-(5-chloro-2-methoxy-phenyl)-4-(p-tolyl)-1H-1,2,4-triazole-5-thione CAS Name: 3-(5-chloro-2-methoxyphenyl)-4-(4-methylphenyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-(5-chloro-2-methoxyphenyl)-4-(4-methylphenyl)-1H-1,2,4-triazole-5-thione Traditional Name: 3-(5-chloro-2-methoxy-phenyl)-4-(p-tolyl)-1H-1,2,4-triazole-5-thione Formula: C16H14ClN3OS MolecularWeight: 331.81986

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NNC2=S)C3=C(C=CC(=C3)Cl)OC

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NNC2=S)C3=C(C=CC(=C3)Cl)OC

InChI

InChI=1S/C16H14ClN3OS/c1-10-3-6-12(7-4-10)20-15(18-19-16(20)22)13-9-11(17)5-8-14(13)21-2/h3-9H,1-2H3,(H,19,22)