4-(2-methoxy-5-methyl-phenyl)-3-phenethyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-(2-methoxy-5-methyl-phenyl)-3-phenethyl-1H-1,2,4-triazole-5-thione Openeye Name: 4-(2-methoxy-5-methyl-phenyl)-3-phenethyl-1H-1,2,4-triazole-5-thione CAS Name: 4-(2-methoxy-5-methylphenyl)-3-phenethyl-1H-1,2,4-triazole-5-thione IUPAC Name: 4-(2-methoxy-5-methylphenyl)-3-phenethyl-1H-1,2,4-triazole-5-thione Traditional Name: 4-(2-methoxy-5-methyl-phenyl)-3-phenethyl-1H-1,2,4-triazole-5-thione Formula: C18H19N3OS MolecularWeight: 325.42796

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)N2C(=NNC2=S)CCC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1)OC)N2C(=NNC2=S)CCC3=CC=CC=C3

InChI

InChI=1S/C18H19N3OS/c1-13-8-10-16(22-2)15(12-13)21-17(19-20-18(21)23)11-9-14-6-4-3-5-7-14/h3-8,10,12H,9,11H2,1-2H3,(H,20,23)